propan-2-yl 3-[3-(cyclohexylcarbamoylamino)propanoylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[3-(cyclohexylcarbamoylamino)propanoylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[3-(cyclohexylcarbamoylamino)propanoylamino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[3-[[(cyclohexylamino)-oxomethyl]amino]-1-oxopropyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[3-(cyclohexylcarbamoylamino)propanoylamino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[3-(cyclohexylcarbamoylamino)propanoylamino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C22H32N4O6 MolecularWeight: 448.51268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCNC(=O)NC2CCCCC2

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCNC(=O)NC2CCCCC2

InChI

InChI=1S/C22H32N4O6/c1-15(2)32-21(28)14-18(17-10-6-7-11-19(17)26(30)31)25-20(27)12-13-23-22(29)24-16-8-4-3-5-9-16/h6-7,10-11,15-16,18H,3-5,8-9,12-14H2,1-2H3,(H,25,27)(H2,23,24,29)