4-[(3-bromophenyl)amino]-6,7-dimethoxy-quinoline-3-carboxylic acid

Systemtic Name: 4-[(3-bromophenyl)amino]-6,7-dimethoxy-quinoline-3-carboxylic acid Openeye Name: 4-(3-bromoanilino)-6,7-dimethoxy-quinoline-3-carboxylic acid CAS Name: 4-(3-bromoanilino)-6,7-dimethoxy-3-quinolinecarboxylic acid IUPAC Name: 4-(3-bromoanilino)-6,7-dimethoxyquinoline-3-carboxylic acid Traditional Name: 4-(3-bromoanilino)-6,7-dimethoxy-quinoline-3-carboxylic acid Formula: C18H15BrN2O4 MolecularWeight: 403.2267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C(=O)O)NC3=CC(=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C(=O)O)NC3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C18H15BrN2O4/c1-24-15-7-12-14(8-16(15)25-2)20-9-13(18(22)23)17(12)21-11-5-3-4-10(19)6-11/h3-9H,1-2H3,(H,20,21)(H,22,23)