methyl 4-oxidanylidene-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]phthalazine-1-carboxylate

Systemtic Name: methyl 4-oxidanylidene-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]phthalazine-1-carboxylate Openeye Name: methyl 4-oxo-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]phthalazine-1-carboxylate CAS Name: 4-oxo-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1-phthalazinecarboxylic acid methyl ester IUPAC Name: methyl 4-oxo-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]phthalazine-1-carboxylate Traditional Name: 4-keto-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]phthalazine-1-carboxylic acid methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=O)C2=CC=CC=C21)CN3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NN(C(=O)C2=CC=CC=C21)CN3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3/c1-28-22(27)20-18-9-5-6-10-19(18)21(26)25(23-20)15-24-13-11-17(12-14-24)16-7-3-2-4-8-16/h2-11H,12-15H2,1H3