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

Systemtic Name: propan-2-yl 3-[3-(cyclopentylcarbonylamino)propanoylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[3-(cyclopentanecarbonylamino)propanoylamino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[3-[[cyclopentyl(oxo)methyl]amino]-1-oxopropyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[3-(cyclopentanecarbonylamino)propanoylamino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[3-(cyclopentanecarbonylamino)propanoylamino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C21H29N3O6 MolecularWeight: 419.47146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCNC(=O)C2CCCC2

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCNC(=O)C2CCCC2

InChI

InChI=1S/C21H29N3O6/c1-14(2)30-20(26)13-17(16-9-5-6-10-18(16)24(28)29)23-19(25)11-12-22-21(27)15-7-3-4-8-15/h5-6,9-10,14-15,17H,3-4,7-8,11-13H2,1-2H3,(H,22,27)(H,23,25)