2-[2-[3-Methyl-5-oxo-1-(4-sulfophenyl)-2-pyrazolin-4-ylidene]ethylidene]-3-benzoxazolinepropionic acid

Catalog Number

ACM72796920

Product Name

2-[2-[3-Methyl-5-oxo-1-(4-sulfophenyl)-2-pyrazolin-4-ylidene]ethylidene]-3-benzoxazolinepropionic acid

Structure

CAS

72796-92-0

Category

Heterocyclic Organic Compound

Synonyms

CID6450433, CID 6450433, 2-(2-(3-Methyl-5-oxo-1-(4-sulfophenyl)-2-pyrazolin-4-ylidene)ethylidene)-3-benzoxazolinepropionic acid, 3(2H)-Benzoxazolepropanoic acid, 2-((1,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene)ethylidene)-, 3(2H)-Benzoxazolepropanoic acid, 2-(2-(1,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene)ethylidene)-, 72796-92-0

IUPAC Name

3-[(2Z)-2-[(2Z)-2-[3-methyl-5-oxo-1-(4-sulfophenyl)pyrazol-4-ylidene]ethylidene]-1,3-benzoxazol-3-yl]propanoic acid

Molecular Weight

469.467160 [g/mol]

Molecular Formula

C22H19N3O7S

Canonical SMILES

CC1=NN(C(=O)C1=CC=C2N(C3=CC=CC=C3O2)CCC(=O)O)C4=CC=C(C=C4)S(=O)(=O)O

InChI Key

CHDGOGCTVGHNTQ-HOYZAGQZSA-N

H-Bond Acceptor

9

H-Bond Donor

2

MSDS

COA

Spec Sheet