methyl 2-[2-[(5-methyl-6-oxidanylidene-1,2-diazinan-4-yl)methyl]phenyl]benzoate

Systemtic Name: methyl 2-[2-[(5-methyl-6-oxidanylidene-1,2-diazinan-4-yl)methyl]phenyl]benzoate Openeye Name: methyl 2-[2-[(5-methyl-6-oxo-hexahydropyridazin-4-yl)methyl]phenyl]benzoate CAS Name: 2-[2-[(5-methyl-6-oxo-4-diazinanyl)methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[(5-methyl-6-oxodiazinan-4-yl)methyl]phenyl]benzoate Traditional Name: 2-[2-[(6-keto-5-methyl-hexahydropyridazin-4-yl)methyl]phenyl]benzoic acid methyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CNNC1=O)CC2=CC=CC=C2C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1C(CNNC1=O)CC2=CC=CC=C2C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C20H22N2O3/c1-13-15(12-21-22-19(13)23)11-14-7-3-4-8-16(14)17-9-5-6-10-18(17)20(24)25-2/h3-10,13,15,21H,11-12H2,1-2H3,(H,22,23)