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

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-piperidine-4-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-piperidine-4-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methylpiperidine-4-carboxamide Traditional Name: N-(2-chlorobenzyl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-isonipecotamide Formula: C23H27ClN2O5S MolecularWeight: 478.98888

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Cl)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(CC1=CC=CC=C1Cl)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H27ClN2O5S/c1-25(16-18-5-2-3-6-20(18)24)23(27)17-9-11-26(12-10-17)32(28,29)19-7-8-21-22(15-19)31-14-4-13-30-21/h2-3,5-8,15,17H,4,9-14,16H2,1H3