6-[5-(4-methoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-(4-methoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-(4-methoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[5-(4-methoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-(4-methoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[5-(4-methoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C3C=CC=CC3=O)N(N2)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C3C=CC=CC3=O)N(N2)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2/c1-26-17-13-11-15(12-14-17)20-22-21(18-9-5-6-10-19(18)25)24(23-20)16-7-3-2-4-8-16/h2-14H,1H3,(H,22,23)