(1R,2S)-2-[(3-ethoxyphenyl)carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[(3-ethoxyphenyl)carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[(3-ethoxyphenyl)carbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[(3-ethoxyanilino)-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[(3-ethoxyphenyl)carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-(m-phenetylcarbamoyl)cyclohexanecarboxylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)[C@H]2CCCC[C@H]2C(=O)O

InChI

InChI=1S/C16H21NO4/c1-2-21-12-7-5-6-11(10-12)17-15(18)13-8-3-4-9-14(13)16(19)20/h5-7,10,13-14H,2-4,8-9H2,1H3,(H,17,18)(H,19,20)/t13-,14+/m0/s1