2-[3-ethoxycarbonyl-2-methyl-5-(4-methylphenyl)pyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[3-ethoxycarbonyl-2-methyl-5-(4-methylphenyl)pyrrol-1-yl]ethanoic acid Openeye Name: 2-[3-ethoxycarbonyl-2-methyl-5-(p-tolyl)pyrrol-1-yl]acetic acid CAS Name: 2-[3-ethoxycarbonyl-2-methyl-5-(4-methylphenyl)-1-pyrrolyl]acetic acid IUPAC Name: 2-[3-ethoxycarbonyl-2-methyl-5-(4-methylphenyl)pyrrol-1-yl]acetic acid Traditional Name: 2-[3-carbethoxy-2-methyl-5-(p-tolyl)pyrrol-1-yl]acetic acid Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CC(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CC(=O)O)C

InChI

InChI=1S/C17H19NO4/c1-4-22-17(21)14-9-15(13-7-5-11(2)6-8-13)18(12(14)3)10-16(19)20/h5-9H,4,10H2,1-3H3,(H,19,20)