ethyl 4-[2-oxidanyl-3-(3-oxidanylidene-5,6-diphenyl-1,2,4-triazin-2-yl)propoxy]benzoate

Systemtic Name: ethyl 4-[2-oxidanyl-3-(3-oxidanylidene-5,6-diphenyl-1,2,4-triazin-2-yl)propoxy]benzoate Openeye Name: ethyl 4-[2-hydroxy-3-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)propoxy]benzoate CAS Name: 4-[2-hydroxy-3-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-hydroxy-3-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)propoxy]benzoate Traditional Name: 4-[2-hydroxy-3-(3-keto-5,6-diphenyl-1,2,4-triazin-2-yl)propoxy]benzoic acid ethyl ester Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CN2C(=O)N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC(CN2C(=O)N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C27H25N3O5/c1-2-34-26(32)21-13-15-23(16-14-21)35-18-22(31)17-30-27(33)28-24(19-9-5-3-6-10-19)25(29-30)20-11-7-4-8-12-20/h3-16,22,31H,2,17-18H2,1H3