(E)-3-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate

Systemtic Name: (E)-3-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate Openeye Name: (E)-3-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate CAS Name: (E)-3-[1-(3,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenoate IUPAC Name: (E)-3-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enoate Traditional Name: (E)-3-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acrylate Formula: C17H18NO2- MolecularWeight: 268.33032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C=CC(=O)[O-])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=C2C)/C=C/C(=O)[O-])C)C

InChI

InChI=1S/C17H19NO2/c1-11-5-7-16(9-12(11)2)18-13(3)10-15(14(18)4)6-8-17(19)20/h5-10H,1-4H3,(H,19,20)/p-1/b8-6+