3-butyl-N-[(E)-(3-ethoxy-4-methoxy-phenyl)methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[(E)-(3-ethoxy-4-methoxy-phenyl)methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[(E)-(3-ethoxy-4-methoxy-phenyl)methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[(E)-(3-ethoxy-4-methoxyphenyl)methylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[(E)-(3-ethoxy-4-methoxyphenyl)methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-[(E)-(3-ethoxy-4-methoxy-benzylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC(=C(C=C3)OC)OCC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CC(=C(C=C3)OC)OCC

InChI

InChI=1S/C23H26N4O4/c1-4-6-13-27-23(29)18-10-8-7-9-17(18)21(26-27)22(28)25-24-15-16-11-12-19(30-3)20(14-16)31-5-2/h7-12,14-15H,4-6,13H2,1-3H3,(H,25,28)/b24-15+