2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]-6-methoxy-phenoxy]ethanenitrile

Systemtic Name: 2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]-6-methoxy-phenoxy]ethanenitrile Openeye Name: 2-[2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)iminomethyl]-6-methoxy-phenoxy]acetonitrile CAS Name: 2-[2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)iminomethyl]-6-methoxyphenoxy]acetonitrile IUPAC Name: 2-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]-6-methoxyphenoxy]acetonitrile Traditional Name: 2-[2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)iminomethyl]-6-methoxy-phenoxy]acetonitrile Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C(=CC=C3)OC)OCC#N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C(=CC=C3)OC)OCC#N

InChI

InChI=1S/C21H20N4O3/c1-15-19(21(26)25(24(15)2)17-9-5-4-6-10-17)23-14-16-8-7-11-18(27-3)20(16)28-13-12-22/h4-11,14H,13H2,1-3H3