1-[(4-methoxyphenyl)methyl]-7-[2-(2-methoxyphenyl)-2-oxidanylidene-ethoxy]-5H-[1,2,3]triazolo[4,5-c][1]benzazepine-4,10-dione

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-7-[2-(2-methoxyphenyl)-2-oxidanylidene-ethoxy]-5H-[1,2,3]triazolo[4,5-c][1]benzazepine-4,10-dione Openeye Name: 1-[(4-methoxyphenyl)methyl]-7-[2-(2-methoxyphenyl)-2-oxo-ethoxy]-5H-triazolo[4,5-c][1]benzazepine-4,10-dione CAS Name: 1-[(4-methoxyphenyl)methyl]-7-[2-(2-methoxyphenyl)-2-oxoethoxy]-5H-triazolo[4,5-c][1]benzazepine-4,10-dione IUPAC Name: 1-[(4-methoxyphenyl)methyl]-7-[2-(2-methoxyphenyl)-2-oxoethoxy]-5H-triazolo[4,5-c][1]benzazepine-4,10-dione Traditional Name: 7-[2-keto-2-(2-methoxyphenyl)ethoxy]-1-p-anisyl-5H-triazolo[4,5-c][1]benzazepine-4,10-quinone Formula: C27H22N4O6 MolecularWeight: 498.48678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=C(C(=O)NC4=C(C3=O)C=CC(=C4)OCC(=O)C5=CC=CC=C5OC)N=N2

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=C(C(=O)NC4=C(C3=O)C=CC(=C4)OCC(=O)C5=CC=CC=C5OC)N=N2

InChI

InChI=1S/C27H22N4O6/c1-35-17-9-7-16(8-10-17)14-31-25-24(29-30-31)27(34)28-21-13-18(11-12-19(21)26(25)33)37-15-22(32)20-5-3-4-6-23(20)36-2/h3-13H,14-15H2,1-2H3,(H,28,34)