2-[[2-methoxy-5-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[2-methoxy-5-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[2-methoxy-5-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[2-methoxy-5-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[2-methoxy-5-[(E)-1,2,4-triazol-4-yliminomethyl]phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[2-methoxy-5-[(E)-1,2,4-triazol-4-yliminomethyl]benzyl]isoindoline-1,3-quinone Formula: C19H15N5O3 MolecularWeight: 361.3541

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NN2C=NN=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/N2C=NN=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H15N5O3/c1-27-17-7-6-13(9-22-23-11-20-21-12-23)8-14(17)10-24-18(25)15-4-2-3-5-16(15)19(24)26/h2-9,11-12H,10H2,1H3/b22-9+