4-methyl-3-(naphthalen-1-ylmethyl)-5,7-bis(2H-1,2,3,4-tetrazol-5-ylmethoxy)chromen-2-one

Systemtic Name: 4-methyl-3-(naphthalen-1-ylmethyl)-5,7-bis(2H-1,2,3,4-tetrazol-5-ylmethoxy)chromen-2-one Openeye Name: 4-methyl-3-(1-naphthylmethyl)-5,7-bis(2H-tetrazol-5-ylmethoxy)chromen-2-one CAS Name: 4-methyl-3-(1-naphthalenylmethyl)-5,7-bis(2H-tetrazol-5-ylmethoxy)-1-benzopyran-2-one IUPAC Name: 4-methyl-3-(naphthalen-1-ylmethyl)-5,7-bis(2H-tetrazol-5-ylmethoxy)chromen-2-one Traditional Name: 4-methyl-3-(1-naphthylmethyl)-5,7-bis(2H-tetrazol-5-ylmethoxy)coumarin Formula: C25H20N8O4 MolecularWeight: 496.4775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=CC(=C12)OCC3=NNN=N3)OCC4=NNN=N4)CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=CC(=C12)OCC3=NNN=N3)OCC4=NNN=N4)CC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C25H20N8O4/c1-14-19(9-16-7-4-6-15-5-2-3-8-18(15)16)25(34)37-21-11-17(35-12-22-26-30-31-27-22)10-20(24(14)21)36-13-23-28-32-33-29-23/h2-8,10-11H,9,12-13H2,1H3,(H,26,27,30,31)(H,28,29,32,33)