phenyl (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-3-yl]prop-2-enoate

Systemtic Name: phenyl (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-3-yl]prop-2-enoate Openeye Name: phenyl (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-3-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-2-oxolanyl]methyl]-3-pyrrolyl]-2-propenoic acid phenyl ester IUPAC Name: phenyl (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-3-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-3-yl]acrylic acid phenyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2CCCO2)C)C=C(C#N)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C[C@H]2CCCO2)C)/C=C(\C#N)/C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3/c1-15-11-17(16(2)23(15)14-20-9-6-10-25-20)12-18(13-22)21(24)26-19-7-4-3-5-8-19/h3-5,7-8,11-12,20H,6,9-10,14H2,1-2H3/b18-12+/t20-/m1/s1