4-methyl-1,3-bis(phenylmethyl)-5,7-bis(2H-1,2,3,4-tetrazol-5-ylmethoxy)quinolin-2-one

Systemtic Name: 4-methyl-1,3-bis(phenylmethyl)-5,7-bis(2H-1,2,3,4-tetrazol-5-ylmethoxy)quinolin-2-one Openeye Name: 1,3-dibenzyl-4-methyl-5,7-bis(2H-tetrazol-5-ylmethoxy)quinolin-2-one CAS Name: 4-methyl-1,3-bis(phenylmethyl)-5,7-bis(2H-tetrazol-5-ylmethoxy)-2-quinolinone IUPAC Name: 1,3-dibenzyl-4-methyl-5,7-bis(2H-tetrazol-5-ylmethoxy)quinolin-2-one Traditional Name: 1,3-dibenzyl-4-methyl-5,7-bis(2H-tetrazol-5-ylmethoxy)carbostyril Formula: C28H25N9O3 MolecularWeight: 535.5566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C2=CC(=CC(=C12)OCC3=NNN=N3)OCC4=NNN=N4)CC5=CC=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=O)N(C2=CC(=CC(=C12)OCC3=NNN=N3)OCC4=NNN=N4)CC5=CC=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C28H25N9O3/c1-18-22(12-19-8-4-2-5-9-19)28(38)37(15-20-10-6-3-7-11-20)23-13-21(39-16-25-29-33-34-30-25)14-24(27(18)23)40-17-26-31-35-36-32-26/h2-11,13-14H,12,15-17H2,1H3,(H,29,30,33,34)(H,31,32,35,36)