(2S)-2-(3-methoxy-4-oxidanyl-phenyl)-2-[(3S)-5-methyl-3-phenyl-1,3-dihydropyrazol-2-yl]ethanenitrile

Systemtic Name: (2S)-2-(3-methoxy-4-oxidanyl-phenyl)-2-[(3S)-5-methyl-3-phenyl-1,3-dihydropyrazol-2-yl]ethanenitrile Openeye Name: (2S)-2-(4-hydroxy-3-methoxy-phenyl)-2-[(3S)-5-methyl-3-phenyl-1,3-dihydropyrazol-2-yl]acetonitrile CAS Name: (2S)-2-(4-hydroxy-3-methoxyphenyl)-2-[(3S)-5-methyl-3-phenyl-1,3-dihydropyrazol-2-yl]acetonitrile IUPAC Name: (2S)-2-(4-hydroxy-3-methoxyphenyl)-2-[(3S)-5-methyl-3-phenyl-1,3-dihydropyrazol-2-yl]acetonitrile Traditional Name: (2S)-2-(4-hydroxy-3-methoxy-phenyl)-2-[(5S)-3-methyl-5-phenyl-3-pyrazolin-1-yl]acetonitrile Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(N1)C(C#N)C2=CC(=C(C=C2)O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C[C@H](N(N1)[C@H](C#N)C2=CC(=C(C=C2)O)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2/c1-13-10-16(14-6-4-3-5-7-14)22(21-13)17(12-20)15-8-9-18(23)19(11-15)24-2/h3-11,16-17,21,23H,1-2H3/t16-,17+/m0/s1