2-[(1-phenylcyclohexyl)carbonylamino]butanedioic acid

Systemtic Name: 2-[(1-phenylcyclohexyl)carbonylamino]butanedioic acid Openeye Name: 2-[(1-phenylcyclohexanecarbonyl)amino]butanedioic acid CAS Name: 2-[[oxo-(1-phenylcyclohexyl)methyl]amino]butanedioic acid IUPAC Name: 2-[(1-phenylcyclohexanecarbonyl)amino]butanedioic acid Traditional Name: 2-[(1-phenylcyclohexanecarbonyl)amino]succinic acid Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC=CC=C2)C(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)(C2=CC=CC=C2)C(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C17H21NO5/c19-14(20)11-13(15(21)22)18-16(23)17(9-5-2-6-10-17)12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,18,23)(H,19,20)(H,21,22)