propan-2-yl 4-(4-nitrophenyl)butanoate

Systemtic Name: propan-2-yl 4-(4-nitrophenyl)butanoate Openeye Name: isopropyl 4-(4-nitrophenyl)butanoate CAS Name: 4-(4-nitrophenyl)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(4-nitrophenyl)butanoate Traditional Name: 4-(4-nitrophenyl)butyric acid isopropyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17NO4/c1-10(2)18-13(15)5-3-4-11-6-8-12(9-7-11)14(16)17/h6-10H,3-5H2,1-2H3