(E)-3-[1-methyl-4-(2-phenylethanoyl)pyrrol-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-methyl-4-(2-phenylethanoyl)pyrrol-2-yl]prop-2-enoic acid Openeye Name: (E)-3-[1-methyl-4-(2-phenylacetyl)pyrrol-2-yl]prop-2-enoic acid CAS Name: (E)-3-[1-methyl-4-(1-oxo-2-phenylethyl)-2-pyrrolyl]-2-propenoic acid IUPAC Name: (E)-3-[1-methyl-4-(2-phenylacetyl)pyrrol-2-yl]prop-2-enoic acid Traditional Name: (E)-3-[1-methyl-4-(2-phenylacetyl)pyrrol-2-yl]acrylic acid Formula: C16H15NO3 MolecularWeight: 269.2952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C=CC(=O)O)C(=O)CC2=CC=CC=C2

Isomeric SMILES

CN1C=C(C=C1/C=C/C(=O)O)C(=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H15NO3/c1-17-11-13(10-14(17)7-8-16(19)20)15(18)9-12-5-3-2-4-6-12/h2-8,10-11H,9H2,1H3,(H,19,20)/b8-7+