3-butyl-N-(2,5-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-(2,5-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-(2,5-dimethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-(2,5-dimethoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-(2,5-dimethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-(2,5-dimethoxyphenyl)-4-keto-phthalazine-1-carboxamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)OC)OC

InChI

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