4-oxidanylidene-N-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]-3-propyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(E)-(2-isopropoxyphenyl)methyleneamino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]-3-propyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]-3-propylphthalazine-1-carboxamide Traditional Name: N-[(E)-(2-isopropoxybenzylidene)amino]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=CC=C3OC(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CC=CC=C3OC(C)C

InChI

InChI=1S/C22H24N4O3/c1-4-13-26-22(28)18-11-7-6-10-17(18)20(25-26)21(27)24-23-14-16-9-5-8-12-19(16)29-15(2)3/h5-12,14-15H,4,13H2,1-3H3,(H,24,27)/b23-14+