(E)-3-(2,4,5-trimethyl-1H-pyrrol-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2,4,5-trimethyl-1H-pyrrol-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(2,4,5-trimethyl-1H-pyrrol-3-yl)prop-2-enoic acid CAS Name: (E)-3-(2,4,5-trimethyl-1H-pyrrol-3-yl)-2-propenoic acid IUPAC Name: (E)-3-(2,4,5-trimethyl-1H-pyrrol-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(2,4,5-trimethyl-1H-pyrrol-3-yl)acrylic acid Formula: C10H13NO2 MolecularWeight: 179.21572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C=CC(=O)O)C)C

Isomeric SMILES

CC1=C(NC(=C1/C=C/C(=O)O)C)C

InChI

InChI=1S/C10H13NO2/c1-6-7(2)11-8(3)9(6)4-5-10(12)13/h4-5,11H,1-3H3,(H,12,13)/b5-4+