4-oxidanylidene-3-propan-2-yl-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-propan-2-yl-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide CAS Name: 4-oxo-3-propan-2-yl-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propan-2-yl-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[(Z)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C(=N\NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)/C

InChI

InChI=1S/C23H26N4O3/c1-5-14-30-18-12-10-17(11-13-18)16(4)24-25-22(28)21-19-8-6-7-9-20(19)23(29)27(26-21)15(2)3/h6-13,15H,5,14H2,1-4H3,(H,25,28)/b24-16-