methyl 7,8-dimethoxy-3-phenyl-4,5-dihydro-1,4-benzothiazepine-2-carboxylate

Systemtic Name: methyl 7,8-dimethoxy-3-phenyl-4,5-dihydro-1,4-benzothiazepine-2-carboxylate Openeye Name: methyl 7,8-dimethoxy-3-phenyl-4,5-dihydro-1,4-benzothiazepine-2-carboxylate CAS Name: 7,8-dimethoxy-3-phenyl-4,5-dihydro-1,4-benzothiazepine-2-carboxylic acid methyl ester IUPAC Name: methyl 7,8-dimethoxy-3-phenyl-4,5-dihydro-1,4-benzothiazepine-2-carboxylate Traditional Name: 7,8-dimethoxy-3-phenyl-4,5-dihydro-1,4-benzothiazepine-2-carboxylic acid methyl ester Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CNC(=C(S2)C(=O)OC)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CNC(=C(S2)C(=O)OC)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H19NO4S/c1-22-14-9-13-11-20-17(12-7-5-4-6-8-12)18(19(21)24-3)25-16(13)10-15(14)23-2/h4-10,20H,11H2,1-3H3