4-azanyl-3-chloranyl-5-nitro-2-phenylazanyl-benzoic acid

Systemtic Name: 4-azanyl-3-chloranyl-5-nitro-2-phenylazanyl-benzoic acid Openeye Name: 4-amino-2-anilino-3-chloro-5-nitro-benzoic acid CAS Name: 4-amino-2-anilino-3-chloro-5-nitrobenzoic acid IUPAC Name: 4-amino-2-anilino-3-chloro-5-nitrobenzoic acid Traditional Name: 4-amino-2-anilino-3-chloro-5-nitro-benzoic acid Formula: C13H10ClN3O4 MolecularWeight: 307.6892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C(=C(C=C2C(=O)O)[N+](=O)[O-])N)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C(=C(C=C2C(=O)O)[N+](=O)[O-])N)Cl

InChI

InChI=1S/C13H10ClN3O4/c14-10-11(15)9(17(20)21)6-8(13(18)19)12(10)16-7-4-2-1-3-5-7/h1-6,16H,15H2,(H,18,19)