3-nitro-4-(1-phenylethylamino)benzoic acid

Systemtic Name: 3-nitro-4-(1-phenylethylamino)benzoic acid Openeye Name: 3-nitro-4-(1-phenylethylamino)benzoic acid CAS Name: 3-nitro-4-(1-phenylethylamino)benzoic acid IUPAC Name: 3-nitro-4-(1-phenylethylamino)benzoic acid Traditional Name: 3-nitro-4-(1-phenylethylamino)benzoic acid Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4/c1-10(11-5-3-2-4-6-11)16-13-8-7-12(15(18)19)9-14(13)17(20)21/h2-10,16H,1H3,(H,18,19)