(1R,2S)-2-[[3-(butylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[[3-(butylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[[3-(butylcarbamoyl)phenyl]carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[[3-[butylamino(oxo)methyl]anilino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[[3-(butylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[[3-(butylcarbamoyl)phenyl]carbamoyl]cyclohexanecarboxylate Formula: C19H25N2O4- MolecularWeight: 345.4128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)NC(=O)C2CCCCC2C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O4/c1-2-3-11-20-17(22)13-7-6-8-14(12-13)21-18(23)15-9-4-5-10-16(15)19(24)25/h6-8,12,15-16H,2-5,9-11H2,1H3,(H,20,22)(H,21,23)(H,24,25)/p-1/t15-,16+/m0/s1