3-[5-(4-methylphenyl)-1-prop-2-enyl-pyrrol-2-yl]propanoate

Systemtic Name: 3-[5-(4-methylphenyl)-1-prop-2-enyl-pyrrol-2-yl]propanoate Openeye Name: 3-[1-allyl-5-(p-tolyl)pyrrol-2-yl]propanoate CAS Name: 3-[5-(4-methylphenyl)-1-prop-2-enyl-2-pyrrolyl]propanoate IUPAC Name: 3-[5-(4-methylphenyl)-1-prop-2-enylpyrrol-2-yl]propanoate Traditional Name: 3-[1-allyl-5-(p-tolyl)pyrrol-2-yl]propionate Formula: C17H18NO2- MolecularWeight: 268.33032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(N2CC=C)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(N2CC=C)CCC(=O)[O-]

InChI

InChI=1S/C17H19NO2/c1-3-12-18-15(9-11-17(19)20)8-10-16(18)14-6-4-13(2)5-7-14/h3-8,10H,1,9,11-12H2,2H3,(H,19,20)/p-1