(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (1-phenyltetrazol-5-yl)methyl 2-methyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-methyl-1,3-dioxo-5-isoindolecarboxylic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl 2-methyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-methyl-isoindoline-5-carboxylic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C18H13N5O4 MolecularWeight: 363.32692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H13N5O4/c1-22-16(24)13-8-7-11(9-14(13)17(22)25)18(26)27-10-15-19-20-21-23(15)12-5-3-2-4-6-12/h2-9H,10H2,1H3