[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl] 3-phenylbutanoate

Systemtic Name: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl] 3-phenylbutanoate Openeye Name: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxo-ethyl] 3-phenylbutanoate CAS Name: 3-phenylbutanoic acid [2-[[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxoethyl] 3-phenylbutanoate Traditional Name: 3-phenylbutyric acid [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-keto-ethyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)NC(=O)NCCC1=CCCCC1)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)OCC(=O)NC(=O)NCCC1=CCCCC1)C2=CC=CC=C2

InChI

InChI=1S/C21H28N2O4/c1-16(18-10-6-3-7-11-18)14-20(25)27-15-19(24)23-21(26)22-13-12-17-8-4-2-5-9-17/h3,6-8,10-11,16H,2,4-5,9,12-15H2,1H3,(H2,22,23,24,26)