methyl 2-[[4-[[(2-methoxyphenyl)carbonylamino]methyl]-4-phenyl-piperidin-1-yl]sulfonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[4-[[(2-methoxyphenyl)carbonylamino]methyl]-4-phenyl-piperidin-1-yl]sulfonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[4-[[(2-methoxybenzoyl)amino]methyl]-4-phenyl-1-piperidyl]sulfonylamino]-3-methyl-butanoate CAS Name: 2-[[4-[[[(2-methoxyphenyl)-oxomethyl]amino]methyl]-4-phenyl-1-piperidinyl]sulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[4-[[(2-methoxybenzoyl)amino]methyl]-4-phenylpiperidin-1-yl]sulfonylamino]-3-methylbutanoate Traditional Name: 3-methyl-2-[[4-[(o-anisoylamino)methyl]-4-phenyl-piperidino]sulfonylamino]butyric acid methyl ester Formula: C26H35N3O6S MolecularWeight: 517.6376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)N1CCC(CC1)(CNC(=O)C2=CC=CC=C2OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)OC)NS(=O)(=O)N1CCC(CC1)(CNC(=O)C2=CC=CC=C2OC)C3=CC=CC=C3

InChI

InChI=1S/C26H35N3O6S/c1-19(2)23(25(31)35-4)28-36(32,33)29-16-14-26(15-17-29,20-10-6-5-7-11-20)18-27-24(30)21-12-8-9-13-22(21)34-3/h5-13,19,23,28H,14-18H2,1-4H3,(H,27,30)