methyl (3R,4S)-4-(4-cyanophenyl)-2-methylidene-4-oxidanyl-3-phenyl-butanoate

Systemtic Name: methyl (3R,4S)-4-(4-cyanophenyl)-2-methylidene-4-oxidanyl-3-phenyl-butanoate Openeye Name: methyl (3R,4S)-4-(4-cyanophenyl)-4-hydroxy-2-methylene-3-phenyl-butanoate CAS Name: (3R,4S)-4-(4-cyanophenyl)-4-hydroxy-2-methylene-3-phenylbutanoic acid methyl ester IUPAC Name: methyl (3R,4S)-4-(4-cyanophenyl)-4-hydroxy-2-methylidene-3-phenylbutanoate Traditional Name: 2-[(1R,2S)-2-(4-cyanophenyl)-2-hydroxy-1-phenyl-ethyl]acrylic acid methyl ester Formula: C19H17NO3 MolecularWeight: 307.34318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C)C(C1=CC=CC=C1)C(C2=CC=C(C=C2)C#N)O

Isomeric SMILES

COC(=O)C(=C)[C@@H](C1=CC=CC=C1)[C@@H](C2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C19H17NO3/c1-13(19(22)23-2)17(15-6-4-3-5-7-15)18(21)16-10-8-14(12-20)9-11-16/h3-11,17-18,21H,1H2,2H3/t17-,18+/m0/s1