3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(2,5-diethoxyphenyl)propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(2,5-diethoxyphenyl)propanamide Openeye Name: N-(2,5-diethoxyphenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-(2,5-diethoxyphenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-(2,5-diethoxyphenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: N-(2,5-diethoxyphenyl)-3-(1,4-diketo-3H-phthalazin-2-yl)propionamide Formula: C21H23N3O5 MolecularWeight: 397.42442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C21H23N3O5/c1-3-28-14-9-10-18(29-4-2)17(13-14)22-19(25)11-12-24-21(27)16-8-6-5-7-15(16)20(26)23-24/h5-10,13H,3-4,11-12H2,1-2H3,(H,22,25)(H,23,26)