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

Systemtic Name: 2-[[4-[[(2-methoxyphenyl)carbonylamino]methyl]-4-phenyl-piperidin-1-yl]sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-[[(2-methoxybenzoyl)amino]methyl]-4-phenyl-1-piperidyl]sulfonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[4-[[[(2-methoxyphenyl)-oxomethyl]amino]methyl]-4-phenyl-1-piperidinyl]sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-[[(2-methoxybenzoyl)amino]methyl]-4-phenylpiperidin-1-yl]sulfonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[4-[(o-anisoylamino)methyl]-4-phenyl-piperidino]sulfonylamino]-3-phenyl-propionic acid Formula: C29H33N3O6S MolecularWeight: 551.65382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C29H33N3O6S/c1-38-26-15-9-8-14-24(26)27(33)30-21-29(23-12-6-3-7-13-23)16-18-32(19-17-29)39(36,37)31-25(28(34)35)20-22-10-4-2-5-11-22/h2-15,25,31H,16-21H2,1H3,(H,30,33)(H,34,35)