2-[3-[(4-chlorophenyl)methoxy]-2-oxidanyl-propyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[3-[(4-chlorophenyl)methoxy]-2-oxidanyl-propyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[3-[(4-chlorophenyl)methoxy]-2-hydroxy-propyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[3-[(4-chlorophenyl)methoxy]-2-hydroxypropyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[3-[(4-chlorophenyl)methoxy]-2-hydroxypropyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[3-(4-chlorobenzyl)oxy-2-hydroxy-propyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C17H18ClN3O3 MolecularWeight: 347.79612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(COCC2=CC=C(C=C2)Cl)O)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(COCC2=CC=C(C=C2)Cl)O)C#N

InChI

InChI=1S/C17H18ClN3O3/c1-11-12(2)20-21(17(23)16(11)7-19)8-15(22)10-24-9-13-3-5-14(18)6-4-13/h3-6,15,22H,8-10H2,1-2H3