1-[(3-ethoxyphenyl)methyl]-N-(4-piperidin-1-ylsulfonylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(3-ethoxyphenyl)methyl]-N-(4-piperidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Openeye Name: 1-[(3-ethoxyphenyl)methyl]-N-[4-(1-piperidylsulfonyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(3-ethoxyphenyl)methyl]-N-[4-(1-piperidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-ethoxyphenyl)methyl]-N-(4-piperidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-(3-ethoxybenzyl)-N-(4-piperidinosulfonylphenyl)isonipecotamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H35N3O4S/c1-2-33-24-8-6-7-21(19-24)20-28-17-13-22(14-18-28)26(30)27-23-9-11-25(12-10-23)34(31,32)29-15-4-3-5-16-29/h6-12,19,22H,2-5,13-18,20H2,1H3,(H,27,30)