8-(3-aminophenyl)-N-butyl-5-methyl-5H-[1,3]dioxolo[4,5-g]phthalazine-6-carboxamide

Systemtic Name: 8-(3-aminophenyl)-N-butyl-5-methyl-5H-[1,3]dioxolo[4,5-g]phthalazine-6-carboxamide Openeye Name: 8-(3-aminophenyl)-N-butyl-5-methyl-5H-[1,3]dioxolo[4,5-g]phthalazine-6-carboxamide CAS Name: 8-(3-aminophenyl)-N-butyl-5-methyl-5H-[1,3]dioxolo[4,5-g]phthalazine-6-carboxamide IUPAC Name: 8-(3-aminophenyl)-N-butyl-5-methyl-5H-[1,3]dioxolo[4,5-g]phthalazine-6-carboxamide Traditional Name: 8-(3-aminophenyl)-N-butyl-5-methyl-5H-[1,3]dioxolo[4,5-g]phthalazine-6-carboxamide Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1C(C2=CC3=C(C=C2C(=N1)C4=CC(=CC=C4)N)OCO3)C

Isomeric SMILES

CCCCNC(=O)N1C(C2=CC3=C(C=C2C(=N1)C4=CC(=CC=C4)N)OCO3)C

InChI

InChI=1S/C21H24N4O3/c1-3-4-8-23-21(26)25-13(2)16-10-18-19(28-12-27-18)11-17(16)20(24-25)14-6-5-7-15(22)9-14/h5-7,9-11,13H,3-4,8,12,22H2,1-2H3,(H,23,26)