3,5-dimethyl-4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 3,5-dimethyl-4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[(E)-3-(4-isopropylphenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 3,5-dimethyl-4-[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 3,5-dimethyl-4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 3,5-dimethyl-4-[(E)-3-p-cumenylacryloyl]-1H-pyrrole-2-carboxylic acid Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C=CC2=CC=C(C=C2)C(C)C)C)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1C(=O)/C=C/C2=CC=C(C=C2)C(C)C)C)C(=O)O

InChI

InChI=1S/C19H21NO3/c1-11(2)15-8-5-14(6-9-15)7-10-16(21)17-12(3)18(19(22)23)20-13(17)4/h5-11,20H,1-4H3,(H,22,23)/b10-7+