3-butyl-4-oxidanylidene-N-[(E)-(3-phenoxyphenyl)methylideneamino]phthalazine-1-carboxamide

Systemtic Name: 3-butyl-4-oxidanylidene-N-[(E)-(3-phenoxyphenyl)methylideneamino]phthalazine-1-carboxamide Openeye Name: 3-butyl-4-oxo-N-[(E)-(3-phenoxyphenyl)methyleneamino]phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-[(E)-(3-phenoxyphenyl)methylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-[(E)-(3-phenoxyphenyl)methylideneamino]phthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-[(E)-(3-phenoxybenzylidene)amino]phthalazine-1-carboxamide Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H24N4O3/c1-2-3-16-30-26(32)23-15-8-7-14-22(23)24(29-30)25(31)28-27-18-19-10-9-13-21(17-19)33-20-11-5-4-6-12-20/h4-15,17-18H,2-3,16H2,1H3,(H,28,31)/b27-18+