2-[5-[(3-methoxyphenyl)methyl]-3-methyl-6-oxidanylidene-pyridazin-1-yl]ethyl methanesulfonate

Systemtic Name: 2-[5-[(3-methoxyphenyl)methyl]-3-methyl-6-oxidanylidene-pyridazin-1-yl]ethyl methanesulfonate Openeye Name: 2-[5-[(3-methoxyphenyl)methyl]-3-methyl-6-oxo-pyridazin-1-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[5-[(3-methoxyphenyl)methyl]-3-methyl-6-oxo-1-pyridazinyl]ethyl ester IUPAC Name: 2-[5-[(3-methoxyphenyl)methyl]-3-methyl-6-oxopyridazin-1-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-(6-keto-5-m-anisyl-3-methyl-pyridazin-1-yl)ethyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C(=C1)CC2=CC(=CC=C2)OC)CCOS(=O)(=O)C

Isomeric SMILES

CC1=NN(C(=O)C(=C1)CC2=CC(=CC=C2)OC)CCOS(=O)(=O)C

InChI

InChI=1S/C16H20N2O5S/c1-12-9-14(10-13-5-4-6-15(11-13)22-2)16(19)18(17-12)7-8-23-24(3,20)21/h4-6,9,11H,7-8,10H2,1-3H3