(E)-3-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)pyrrol-3-yl]prop-2-enoate

Systemtic Name: (E)-3-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)pyrrol-3-yl]prop-2-enoate Openeye Name: (E)-3-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)pyrrol-3-yl]prop-2-enoate CAS Name: (E)-3-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)-3-pyrrolyl]-2-propenoate IUPAC Name: (E)-3-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)pyrrol-3-yl]prop-2-enoate Traditional Name: (E)-3-(1-mesityl-2,5-dimethyl-pyrrol-3-yl)acrylate Formula: C18H20NO2- MolecularWeight: 282.3569

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO2/c1-11-8-12(2)18(13(3)9-11)19-14(4)10-16(15(19)5)6-7-17(20)21/h6-10H,1-5H3,(H,20,21)/p-1/b7-6+