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

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: 3-(1,4-diketo-3H-phthalazin-2-yl)-N-veratryl-propionamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2)OC

InChI

InChI=1S/C20H21N3O5/c1-27-16-8-7-13(11-17(16)28-2)12-21-18(24)9-10-23-20(26)15-6-4-3-5-14(15)19(25)22-23/h3-8,11H,9-10,12H2,1-2H3,(H,21,24)(H,22,25)