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

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(2-methoxy-5-methyl-phenyl)methyl]-N-methyl-piperidine-4-carboxamide Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(2-methoxy-5-methyl-phenyl)methyl]-N-methyl-piperidine-4-carboxamide CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(2-methoxy-5-methylphenyl)methyl]-N-methylpiperidine-4-carboxamide Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-(2-methoxy-5-methyl-benzyl)-N-methyl-isonipecotamide Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H32N2O6S/c1-18-5-7-22(31-3)20(15-18)17-26(2)25(28)19-9-11-27(12-10-19)34(29,30)21-6-8-23-24(16-21)33-14-4-13-32-23/h5-8,15-16,19H,4,9-14,17H2,1-3H3