4-[(3-azanyl-4-nitro-phenyl)amino]butanoate

Systemtic Name: 4-[(3-azanyl-4-nitro-phenyl)amino]butanoate Openeye Name: 4-(3-amino-4-nitro-anilino)butanoate CAS Name: 4-(3-amino-4-nitroanilino)butanoate IUPAC Name: 4-(3-amino-4-nitroanilino)butanoate Traditional Name: 4-(3-amino-4-nitro-anilino)butyrate Formula: C10H12N3O4- MolecularWeight: 238.21998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCCCC(=O)[O-])N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1NCCCC(=O)[O-])N)[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O4/c11-8-6-7(3-4-9(8)13(16)17)12-5-1-2-10(14)15/h3-4,6,12H,1-2,5,11H2,(H,14,15)/p-1