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

Systemtic Name: 4-[(E)-3-(2-ethoxyphenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[(E)-3-(2-ethoxyphenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-[(E)-3-(2-ethoxyphenyl)-1-oxoprop-2-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[(E)-3-(2-ethoxyphenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 3,5-dimethyl-4-[(E)-3-o-phenetylacryloyl]-1H-pyrrole-2-carboxylic acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=CC(=O)C2=C(NC(=C2C)C(=O)O)C

Isomeric SMILES

CCOC1=CC=CC=C1/C=C/C(=O)C2=C(NC(=C2C)C(=O)O)C

InChI

InChI=1S/C18H19NO4/c1-4-23-15-8-6-5-7-13(15)9-10-14(20)16-11(2)17(18(21)22)19-12(16)3/h5-10,19H,4H2,1-3H3,(H,21,22)/b10-9+