methyl 2-[1-(3-nitrophenyl)propylamino]ethanoate

Systemtic Name: methyl 2-[1-(3-nitrophenyl)propylamino]ethanoate Openeye Name: methyl 2-[1-(3-nitrophenyl)propylamino]acetate CAS Name: 2-[1-(3-nitrophenyl)propylamino]acetic acid methyl ester IUPAC Name: methyl 2-[1-(3-nitrophenyl)propylamino]acetate Traditional Name: 2-[1-(3-nitrophenyl)propylamino]acetic acid methyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4/c1-3-11(13-8-12(15)18-2)9-5-4-6-10(7-9)14(16)17/h4-7,11,13H,3,8H2,1-2H3