1-[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxy-benzoyl]piperidine-4-carboxamide CAS Name: 1-[[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxybenzoyl]piperidine-4-carboxamide Traditional Name: 1-[2-[benzyl(mesyl)amino]-4,5-dimethoxy-benzoyl]isonipecotamide Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)C(=O)N)N(CC3=CC=CC=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)C(=O)N)N(CC3=CC=CC=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C23H29N3O6S/c1-31-20-13-18(23(28)25-11-9-17(10-12-25)22(24)27)19(14-21(20)32-2)26(33(3,29)30)15-16-7-5-4-6-8-16/h4-8,13-14,17H,9-12,15H2,1-3H3,(H2,24,27)