2H-1,2,3,4-tetrazol-5-yl 2-(4-bromophenyl)-6-chloranyl-8-methyl-quinoline-4-carboxylate

Systemtic Name: 2H-1,2,3,4-tetrazol-5-yl 2-(4-bromophenyl)-6-chloranyl-8-methyl-quinoline-4-carboxylate Openeye Name: 2H-tetrazol-5-yl 2-(4-bromophenyl)-6-chloro-8-methyl-quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-6-chloro-8-methyl-4-quinolinecarboxylic acid 2H-tetrazol-5-yl ester IUPAC Name: 2H-tetrazol-5-yl 2-(4-bromophenyl)-6-chloro-8-methylquinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)-6-chloro-8-methyl-cinchoninic acid 2H-tetrazol-5-yl ester Formula: C18H11BrClN5O2 MolecularWeight: 444.66924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Cl)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)OC4=NNN=N4

Isomeric SMILES

CC1=C2C(=CC(=C1)Cl)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)OC4=NNN=N4

InChI

InChI=1S/C18H11BrClN5O2/c1-9-6-12(20)7-13-14(17(26)27-18-22-24-25-23-18)8-15(21-16(9)13)10-2-4-11(19)5-3-10/h2-8H,1H3,(H,22,23,24,25)