phenyl (1E)-4-[[(2-methoxyphenyl)carbonylamino]methyl]-N-methylsulfonyl-4-phenyl-piperidine-1-carboximidate

Systemtic Name: phenyl (1E)-4-[[(2-methoxyphenyl)carbonylamino]methyl]-N-methylsulfonyl-4-phenyl-piperidine-1-carboximidate Openeye Name: phenyl (1E)-4-[[(2-methoxybenzoyl)amino]methyl]-N-methylsulfonyl-4-phenyl-piperidine-1-carboximidate CAS Name: (1E)-4-[[[(2-methoxyphenyl)-oxomethyl]amino]methyl]-N-methylsulfonyl-4-phenyl-1-piperidinecarboximidic acid phenyl ester IUPAC Name: phenyl (1E)-4-[[(2-methoxybenzoyl)amino]methyl]-N-methylsulfonyl-4-phenylpiperidine-1-carboximidate Traditional Name: (1E)-N-mesyl-4-[(o-anisoylamino)methyl]-4-phenyl-piperidine-1-carboximidic acid phenyl ester Formula: C28H31N3O5S MolecularWeight: 521.62784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(=NS(=O)(=O)C)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)/C(=N\S(=O)(=O)C)/OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O5S/c1-35-25-16-10-9-15-24(25)26(32)29-21-28(22-11-5-3-6-12-22)17-19-31(20-18-28)27(30-37(2,33)34)36-23-13-7-4-8-14-23/h3-16H,17-21H2,1-2H3,(H,29,32)/b30-27+