2-oxidanylidene-N-[(3,4,5-triethoxyphenyl)methyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[(3,4,5-triethoxyphenyl)methyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: 2-oxo-N-[(3,4,5-triethoxyphenyl)methyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: 2-oxo-N-[(3,4,5-triethoxyphenyl)methyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: 2-oxo-N-[(3,4,5-triethoxyphenyl)methyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: 2-keto-N-(3,4,5-triethoxybenzyl)-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)CNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)CNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

InChI

InChI=1S/C23H30N2O6S/c1-4-29-20-12-16(13-21(30-5-2)23(20)31-6-3)15-24-32(27,28)18-10-11-19-17(14-18)8-7-9-22(26)25-19/h10-14,24H,4-9,15H2,1-3H3,(H,25,26)