3-[5-(4-methoxyphenyl)-1-(2-methylpropyl)pyrrol-2-yl]propanoate

Systemtic Name: 3-[5-(4-methoxyphenyl)-1-(2-methylpropyl)pyrrol-2-yl]propanoate Openeye Name: 3-[1-isobutyl-5-(4-methoxyphenyl)pyrrol-2-yl]propanoate CAS Name: 3-[5-(4-methoxyphenyl)-1-(2-methylpropyl)-2-pyrrolyl]propanoate IUPAC Name: 3-[5-(4-methoxyphenyl)-1-(2-methylpropyl)pyrrol-2-yl]propanoate Traditional Name: 3-[1-isobutyl-5-(4-methoxyphenyl)pyrrol-2-yl]propionate Formula: C18H22NO3- MolecularWeight: 300.37218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CC=C1C2=CC=C(C=C2)OC)CCC(=O)[O-]

Isomeric SMILES

CC(C)CN1C(=CC=C1C2=CC=C(C=C2)OC)CCC(=O)[O-]

InChI

InChI=1S/C18H23NO3/c1-13(2)12-19-15(7-11-18(20)21)6-10-17(19)14-4-8-16(22-3)9-5-14/h4-6,8-10,13H,7,11-12H2,1-3H3,(H,20,21)/p-1