6-bromanyl-4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-8-methyl-quinoline-3-carboxylic acid; N-methylmethanamine

Systemtic Name: 6-bromanyl-4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-8-methyl-quinoline-3-carboxylic acid; N-methylmethanamine Openeye Name: 6-bromo-4-[(3-chloro-4-methoxy-phenyl)methylamino]-8-methyl-quinoline-3-carboxylic acid; N-methylmethanamine CAS Name: 6-bromo-4-[(3-chloro-4-methoxyphenyl)methylamino]-8-methyl-3-quinolinecarboxylic acid; N-methylmethanamine IUPAC Name: 6-bromo-4-[(3-chloro-4-methoxyphenyl)methylamino]-8-methylquinoline-3-carboxylic acid; N-methylmethanamine Traditional Name: 6-bromo-4-[(3-chloro-4-methoxy-benzyl)amino]-8-methyl-quinoline-3-carboxylic acid; dimethylamine Formula: C21H23BrClN3O3 MolecularWeight: 480.78262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)C(=C(C=N2)C(=O)O)NCC3=CC(=C(C=C3)OC)Cl.CNC

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)C(=C(C=N2)C(=O)O)NCC3=CC(=C(C=C3)OC)Cl.CNC

InChI

InChI=1S/C19H16BrClN2O3.C2H7N/c1-10-5-12(20)7-13-17(10)23-9-14(19(24)25)18(13)22-8-11-3-4-16(26-2)15(21)6-11;1-3-2/h3-7,9H,8H2,1-2H3,(H,22,23)(H,24,25);3H,1-2H3