methyl 4-[2-[(3-nitrophenyl)amino]ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-[(3-nitrophenyl)amino]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-(3-nitroanilino)acetyl]amino]butanoate CAS Name: 4-[[2-(3-nitroanilino)-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-nitroanilino)acetyl]amino]butanoate Traditional Name: 4-[[2-(3-nitroanilino)acetyl]amino]butyric acid methyl ester Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)CNC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCNC(=O)CNC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5/c1-21-13(18)6-3-7-14-12(17)9-15-10-4-2-5-11(8-10)16(19)20/h2,4-5,8,15H,3,6-7,9H2,1H3,(H,14,17)