1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-1-(4-methylphenyl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-1-(4-methylphenyl)propyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-1-(p-tolyl)propyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-1-(4-methylphenyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-1-(4-methylphenyl)propyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-1-(p-tolyl)propyl]isonipecotamide Formula: C25H32N2O5S MolecularWeight: 472.59698

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H32N2O5S/c1-3-22(19-7-5-18(2)6-8-19)26-25(28)20-11-13-27(14-12-20)33(29,30)21-9-10-23-24(17-21)32-16-4-15-31-23/h5-10,17,20,22H,3-4,11-16H2,1-2H3,(H,26,28)/t22-/m0/s1