N-butyl-3-(2,4-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-butyl-3-(2,4-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-butyl-3-(2,4-dimethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-butyl-3-(2,4-dimethoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-butyl-3-(2,4-dimethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-butyl-3-(2,4-dimethoxyphenyl)-4-keto-phthalazine-1-carboxamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H23N3O4/c1-4-5-12-22-20(25)19-15-8-6-7-9-16(15)21(26)24(23-19)17-11-10-14(27-2)13-18(17)28-3/h6-11,13H,4-5,12H2,1-3H3,(H,22,25)