methyl 3-[1-(3-nitrophenyl)propylamino]propanoate

Systemtic Name: methyl 3-[1-(3-nitrophenyl)propylamino]propanoate Openeye Name: methyl 3-[1-(3-nitrophenyl)propylamino]propanoate CAS Name: 3-[1-(3-nitrophenyl)propylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(3-nitrophenyl)propylamino]propanoate Traditional Name: 3-[1-(3-nitrophenyl)propylamino]propionic acid methyl ester Formula: C13H18N2O4 MolecularWeight: 266.29302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NCCC(=O)OC

Isomeric SMILES

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NCCC(=O)OC

InChI

InChI=1S/C13H18N2O4/c1-3-12(14-8-7-13(16)19-2)10-5-4-6-11(9-10)15(17)18/h4-6,9,12,14H,3,7-8H2,1-2H3