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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC(=C(C=C3)OCCC)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CC(=C(C=C3)OCCC)OC

InChI

InChI=1S/C23H26N4O4/c1-4-12-27-23(29)18-9-7-6-8-17(18)21(26-27)22(28)25-24-15-16-10-11-19(31-13-5-2)20(14-16)30-3/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,25,28)/b24-15+