8-(3-methyl-5,6-diphenyl-3H-1,2,4-triazin-2-yl)-2-oxidanylidene-octanoate

Systemtic Name: 8-(3-methyl-5,6-diphenyl-3H-1,2,4-triazin-2-yl)-2-oxidanylidene-octanoate Openeye Name: 8-(3-methyl-5,6-diphenyl-3H-1,2,4-triazin-2-yl)-2-oxo-octanoate CAS Name: 8-(3-methyl-5,6-diphenyl-3H-1,2,4-triazin-2-yl)-2-oxooctanoate IUPAC Name: 8-(3-methyl-5,6-diphenyl-3H-1,2,4-triazin-2-yl)-2-oxooctanoate Traditional Name: 2-keto-8-(3-methyl-5,6-diphenyl-3H-1,2,4-triazin-2-yl)caprylate Formula: C24H26N3O3- MolecularWeight: 404.48154

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Descriptors Computed from Structure

Canonical SMILES:

CC1N=C(C(=NN1CCCCCCC(=O)C(=O)[O-])C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1N=C(C(=NN1CCCCCCC(=O)C(=O)[O-])C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O3/c1-18-25-22(19-12-6-4-7-13-19)23(20-14-8-5-9-15-20)26-27(18)17-11-3-2-10-16-21(28)24(29)30/h4-9,12-15,18H,2-3,10-11,16-17H2,1H3,(H,29,30)/p-1