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

Systemtic Name: (1S,2R)-2-[(4-butylphenyl)carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1S,2R)-2-[(4-butylphenyl)carbamoyl]cyclohexanecarboxylic acid CAS Name: (1S,2R)-2-[(4-butylanilino)-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R)-2-[(4-butylphenyl)carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1S,2R)-2-[(4-butylphenyl)carbamoyl]cyclohexanecarboxylic acid Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O

InChI

InChI=1S/C18H25NO3/c1-2-3-6-13-9-11-14(12-10-13)19-17(20)15-7-4-5-8-16(15)18(21)22/h9-12,15-16H,2-8H2,1H3,(H,19,20)(H,21,22)/t15-,16+/m1/s1