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

Systemtic Name: ethyl 1-[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxy-benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxybenzoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[benzyl(mesyl)amino]-4,5-dimethoxy-benzoyl]isonipecotic acid ethyl ester Formula: C25H32N2O7S MolecularWeight: 504.59578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2N(CC3=CC=CC=C3)S(=O)(=O)C)OC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2N(CC3=CC=CC=C3)S(=O)(=O)C)OC)OC

InChI

InChI=1S/C25H32N2O7S/c1-5-34-25(29)19-11-13-26(14-12-19)24(28)20-15-22(32-2)23(33-3)16-21(20)27(35(4,30)31)17-18-9-7-6-8-10-18/h6-10,15-16,19H,5,11-14,17H2,1-4H3