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

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-1-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]isonipecotamide Formula: C23H26ClN3O5S MolecularWeight: 491.98764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4)Cl

InChI

InChI=1S/C23H26ClN3O5S/c1-32-21-8-5-17(14-19(21)24)25-23(29)15-9-11-27(12-10-15)33(30,31)18-6-7-20-16(13-18)3-2-4-22(28)26-20/h5-8,13-15H,2-4,9-12H2,1H3,(H,25,29)(H,26,28)