N-butyl-3-(3-methoxyphenyl)-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-butyl-3-(3-methoxyphenyl)-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-butyl-3-(3-methoxyphenyl)-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-butyl-3-(3-methoxyphenyl)-N-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-butyl-3-(3-methoxyphenyl)-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-butyl-4-keto-3-(3-methoxyphenyl)-N-methyl-phthalazine-1-carboxamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3/c1-4-5-13-23(2)21(26)19-17-11-6-7-12-18(17)20(25)24(22-19)15-9-8-10-16(14-15)27-3/h6-12,14H,4-5,13H2,1-3H3