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

Systemtic Name: (1R,2S)-2-[[4-(butylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[[4-(butylcarbamoyl)phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[4-[butylamino(oxo)methyl]anilino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[[4-(butylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[[4-(butylcarbamoyl)phenyl]carbamoyl]cyclohexanecarboxylic acid Formula: C19H26N2O4 MolecularWeight: 346.42074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O4/c1-2-3-12-20-17(22)13-8-10-14(11-9-13)21-18(23)15-6-4-5-7-16(15)19(24)25/h8-11,15-16H,2-7,12H2,1H3,(H,20,22)(H,21,23)(H,24,25)/t15-,16+/m0/s1