4-[(3-bromanyl-4-methyl-phenyl)amino]-7-chloranyl-8-methyl-quinoline-3-carboxylic acid

Systemtic Name: 4-[(3-bromanyl-4-methyl-phenyl)amino]-7-chloranyl-8-methyl-quinoline-3-carboxylic acid Openeye Name: 4-(3-bromo-4-methyl-anilino)-7-chloro-8-methyl-quinoline-3-carboxylic acid CAS Name: 4-(3-bromo-4-methylanilino)-7-chloro-8-methyl-3-quinolinecarboxylic acid IUPAC Name: 4-(3-bromo-4-methylanilino)-7-chloro-8-methylquinoline-3-carboxylic acid Traditional Name: 4-(3-bromo-4-methyl-anilino)-7-chloro-8-methyl-quinoline-3-carboxylic acid Formula: C18H14BrClN2O2 MolecularWeight: 405.67296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C3C=CC(=C(C3=NC=C2C(=O)O)C)Cl)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C3C=CC(=C(C3=NC=C2C(=O)O)C)Cl)Br

InChI

InChI=1S/C18H14BrClN2O2/c1-9-3-4-11(7-14(9)19)22-17-12-5-6-15(20)10(2)16(12)21-8-13(17)18(23)24/h3-8H,1-2H3,(H,21,22)(H,23,24)