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

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-3-methyl-1-phenyl-butyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-3-methyl-1-phenyl-butyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-3-methyl-1-phenylbutyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-3-methyl-1-phenylbutyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(1S)-3-methyl-1-phenyl-butyl]isonipecotamide Formula: C26H34N2O5S MolecularWeight: 486.62356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N2O5S/c1-19(2)17-23(20-7-4-3-5-8-20)27-26(29)21-11-13-28(14-12-21)34(30,31)22-9-10-24-25(18-22)33-16-6-15-32-24/h3-5,7-10,18-19,21,23H,6,11-17H2,1-2H3,(H,27,29)/t23-/m0/s1