N-[(4-ethoxyphenyl)methyl]-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-[(4-ethoxyphenyl)methyl]-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[(4-ethoxyphenyl)methyl]-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[(4-ethoxyphenyl)methyl]-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: N-(4-ethoxybenzyl)-1-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]nipecotamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

InChI

InChI=1S/C25H31N3O5S/c1-2-33-21-10-8-18(9-11-21)16-26-25(30)20-6-4-14-28(17-20)34(31,32)22-12-13-23-19(15-22)5-3-7-24(29)27-23/h8-13,15,20H,2-7,14,16-17H2,1H3,(H,26,30)(H,27,29)