3-nitro-2-(quinolin-5-ylamino)benzoic acid

Systemtic Name: 3-nitro-2-(quinolin-5-ylamino)benzoic acid Openeye Name: 3-nitro-2-(5-quinolylamino)benzoic acid CAS Name: 3-nitro-2-(5-quinolinylamino)benzoic acid IUPAC Name: 3-nitro-2-(quinolin-5-ylamino)benzoic acid Traditional Name: 3-nitro-2-(5-quinolylamino)benzoic acid Formula: C16H11N3O4 MolecularWeight: 309.27624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])NC2=CC=CC3=C2C=CC=N3)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])NC2=CC=CC3=C2C=CC=N3)C(=O)O

InChI

InChI=1S/C16H11N3O4/c20-16(21)11-4-1-8-14(19(22)23)15(11)18-13-7-2-6-12-10(13)5-3-9-17-12/h1-9,18H,(H,20,21)