(1R,2S)-2-[[4-(propanoylamino)phenyl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[[4-(propanoylamino)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[[4-(propanoylamino)phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[oxo-[4-(1-oxopropylamino)anilino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[[4-(propanoylamino)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[(4-propionamidophenyl)carbamoyl]cyclohexanecarboxylic acid Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)NC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)NC(=O)[C@H]2CCCC[C@H]2C(=O)O

InChI

InChI=1S/C17H22N2O4/c1-2-15(20)18-11-7-9-12(10-8-11)19-16(21)13-5-3-4-6-14(13)17(22)23/h7-10,13-14H,2-6H2,1H3,(H,18,20)(H,19,21)(H,22,23)/t13-,14+/m0/s1