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3-methyl-4-oxidanylidene-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide

3-methyl-4-oxidanylidene-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide

Systemtic Name:3-methyl-4-oxidanylidene-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide
Openeye Name:3-methyl-4-oxo-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide
CAS Name:3-methyl-4-oxo-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]-1-phthalazinecarboxamide
IUPAC Name:3-methyl-4-oxo-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide
Traditional Name:4-keto-3-methyl-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide
Formula: C21H22N4O3
MolecularWeight: 378.42438
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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


Isomeric SMILES

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


InChI

InChI=1S/C21H22N4O3/c1-4-13-28-16-11-9-15(10-12-16)14(2)22-23-20(26)19-17-7-5-6-8-18(17)21(27)25(3)24-19/h5-12H,4,13H2,1-3H3,(H,23,26)/b22-14+


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