4-[methyl-[(3-nitrophenyl)carbamoyl]amino]butanoic acid

Systemtic Name: 4-[methyl-[(3-nitrophenyl)carbamoyl]amino]butanoic acid Openeye Name: 4-[methyl-[(3-nitrophenyl)carbamoyl]amino]butanoic acid CAS Name: 4-[methyl-[(3-nitroanilino)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[methyl-[(3-nitrophenyl)carbamoyl]amino]butanoic acid Traditional Name: 4-[methyl-[(3-nitrophenyl)carbamoyl]amino]butyric acid Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CN(CCCC(=O)O)C(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O5/c1-14(7-3-6-11(16)17)12(18)13-9-4-2-5-10(8-9)15(19)20/h2,4-5,8H,3,6-7H2,1H3,(H,13,18)(H,16,17)