1-methyl-6-pentan-3-yl-3-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-4H-quinoline-4-carboxylic acid

Systemtic Name: 1-methyl-6-pentan-3-yl-3-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-4H-quinoline-4-carboxylic acid Openeye Name: 6-(1-ethylpropyl)-1-methyl-3-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-4H-quinoline-4-carboxylic acid CAS Name: 1-methyl-6-pentan-3-yl-3-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-4H-quinoline-4-carboxylic acid IUPAC Name: 1-methyl-6-pentan-3-yl-3-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-4H-quinoline-4-carboxylic acid Traditional Name: 6-(1-ethylpropyl)-1-methyl-3-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-4H-quinoline-4-carboxylic acid Formula: C29H29N5O2 MolecularWeight: 479.57286

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC2=C(C=C1)N(C=C(C2C(=O)O)C3=CC(=C(C=C3)C4=CC=CC=C4)C5=NNN=N5)C

Isomeric SMILES

CCC(CC)C1=CC2=C(C=C1)N(C=C(C2C(=O)O)C3=CC(=C(C=C3)C4=CC=CC=C4)C5=NNN=N5)C

InChI

InChI=1S/C29H29N5O2/c1-4-18(5-2)20-12-14-26-24(15-20)27(29(35)36)25(17-34(26)3)21-11-13-22(19-9-7-6-8-10-19)23(16-21)28-30-32-33-31-28/h6-18,27H,4-5H2,1-3H3,(H,35,36)(H,30,31,32,33)