ethyl 4-[2-(1H-benzimidazol-2-yl)ethylamino]-6-chloranyl-8-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[2-(1H-benzimidazol-2-yl)ethylamino]-6-chloranyl-8-methyl-quinoline-3-carboxylate Openeye Name: ethyl 4-[2-(1H-benzimidazol-2-yl)ethylamino]-6-chloro-8-methyl-quinoline-3-carboxylate CAS Name: 4-[2-(1H-benzimidazol-2-yl)ethylamino]-6-chloro-8-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1H-benzimidazol-2-yl)ethylamino]-6-chloro-8-methylquinoline-3-carboxylate Traditional Name: 4-[2-(1H-benzimidazol-2-yl)ethylamino]-6-chloro-8-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C22H21ClN4O2 MolecularWeight: 408.88074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)Cl)NCCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)Cl)NCCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H21ClN4O2/c1-3-29-22(28)16-12-25-20-13(2)10-14(23)11-15(20)21(16)24-9-8-19-26-17-6-4-5-7-18(17)27-19/h4-7,10-12H,3,8-9H2,1-2H3,(H,24,25)(H,26,27)