methyl 6-butan-2-yl-1-methyl-3-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-4H-quinoline-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29N5O2/c1-5-18(2)20-12-14-26-24(15-20)27(29(35)36-4)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,5H2,1-4H3,(H,30,31,32,33)