CAS
87029-84-3 Purity
96%
87029-84-3 Purity
96%
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6-[3-(Dimethylamino)propyl]-5,6-dihydrobenzo[b][1]benzothiepine-5-carbonitrile; 2-hydroxy-2-oxoacetate
CAS
87033-51-0
Catalog Number
ACM87033510
Category
Other Products
Molecular Weight
411.494 g/mol
Molecular Formula
C22H23N2O4S-
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Specification
IUPAC Name
6-[3-(dimethylamino)propyl]-5,6-dihydrobenzo[b][1]benzothiepine-5-carbonitrile;2-hydroxy-2-oxoacetate
Canonical SMILES
CN(C)CCCC1C(C2=CC=CC=C2SC3=CC=CC=C13)C#N.C(=O)(C(=O)[O-])O
InChI Key
YNWDETZEXVPRAI-UHFFFAOYSA-M
Exact Mass
411.13800
H-Bond Acceptor
7
H-Bond Donor
1
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