N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)OCC

InChI

InChI=1S/C22H25N3O4/c1-4-28-18-11-10-15(14-19(18)29-5-2)12-13-23-21(26)20-16-8-6-7-9-17(16)22(27)25(3)24-20/h6-11,14H,4-5,12-13H2,1-3H3,(H,23,26)