N-(2,5-diethoxyphenyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(2,5-diethoxyphenyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(2,5-diethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2,5-diethoxyphenyl)-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-(2,5-diethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(2,5-diethoxyphenyl)-4-keto-phthalazine-1-carboxamide Formula: C26H25N3O4 MolecularWeight: 443.4944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O4/c1-3-32-19-14-15-23(33-4-2)22(16-19)27-25(30)24-20-12-8-9-13-21(20)26(31)29(28-24)17-18-10-6-5-7-11-18/h5-16H,3-4,17H2,1-2H3,(H,27,30)