2-[(R)-[(4S)-1-ethyl-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]-(2-methoxyphenyl)methyl]propanedinitrile

Systemtic Name: 2-[(R)-[(4S)-1-ethyl-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]-(2-methoxyphenyl)methyl]propanedinitrile Openeye Name: 2-[(R)-[(4S)-1-ethyl-3-methyl-5-oxo-4H-pyrazol-4-yl]-(2-methoxyphenyl)methyl]propanedinitrile CAS Name: 2-[(R)-[(4S)-1-ethyl-3-methyl-5-oxo-4H-pyrazol-4-yl]-(2-methoxyphenyl)methyl]propanedinitrile IUPAC Name: 2-[(R)-[(4S)-1-ethyl-3-methyl-5-oxo-4H-pyrazol-4-yl]-(2-methoxyphenyl)methyl]propanedinitrile Traditional Name: 2-[(R)-[(4S)-1-ethyl-5-keto-3-methyl-2-pyrazolin-4-yl]-(2-methoxyphenyl)methyl]malononitrile Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(C(=N1)C)C(C2=CC=CC=C2OC)C(C#N)C#N

Isomeric SMILES

CCN1C(=O)[C@H](C(=N1)C)[C@H](C2=CC=CC=C2OC)C(C#N)C#N

InChI

InChI=1S/C17H18N4O2/c1-4-21-17(22)15(11(2)20-21)16(12(9-18)10-19)13-7-5-6-8-14(13)23-3/h5-8,12,15-16H,4H2,1-3H3/t15-,16+/m1/s1