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

Systemtic Name: 2-[[4-[[(2-methoxyphenyl)carbonylamino]methyl]-4-phenyl-piperidin-1-yl]sulfonylamino]propanoic acid Openeye Name: 2-[[4-[[(2-methoxybenzoyl)amino]methyl]-4-phenyl-1-piperidyl]sulfonylamino]propanoic acid CAS Name: 2-[[4-[[[(2-methoxyphenyl)-oxomethyl]amino]methyl]-4-phenyl-1-piperidinyl]sulfonylamino]propanoic acid IUPAC Name: 2-[[4-[[(2-methoxybenzoyl)amino]methyl]-4-phenylpiperidin-1-yl]sulfonylamino]propanoic acid Traditional Name: 2-[[4-[(o-anisoylamino)methyl]-4-phenyl-piperidino]sulfonylamino]propionic acid Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O6S/c1-17(22(28)29)25-33(30,31)26-14-12-23(13-15-26,18-8-4-3-5-9-18)16-24-21(27)19-10-6-7-11-20(19)32-2/h3-11,17,25H,12-16H2,1-2H3,(H,24,27)(H,28,29)