N-[2-(3,4-diethoxyphenyl)ethyl]-4-(3-methyl-4-oxidanylidene-phthalazin-1-yl)benzamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-(3-methyl-4-oxidanylidene-phthalazin-1-yl)benzamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-(3-methyl-4-oxo-phthalazin-1-yl)benzamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-(3-methyl-4-oxo-1-phthalazinyl)benzamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-(3-methyl-4-oxophthalazin-1-yl)benzamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-(4-keto-3-methyl-phthalazin-1-yl)benzamide Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C3=NN(C(=O)C4=CC=CC=C43)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C3=NN(C(=O)C4=CC=CC=C43)C)OCC

InChI

InChI=1S/C28H29N3O4/c1-4-34-24-15-10-19(18-25(24)35-5-2)16-17-29-27(32)21-13-11-20(12-14-21)26-22-8-6-7-9-23(22)28(33)31(3)30-26/h6-15,18H,4-5,16-17H2,1-3H3,(H,29,32)