2-[2,5-dimethyl-1-[4-(3-methylbutoxy)phenyl]pyrrol-3-yl]ethanoic acid

Systemtic Name: 2-[2,5-dimethyl-1-[4-(3-methylbutoxy)phenyl]pyrrol-3-yl]ethanoic acid Openeye Name: 2-[1-(4-isopentyloxyphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid CAS Name: 2-[2,5-dimethyl-1-[4-(3-methylbutoxy)phenyl]-3-pyrrolyl]acetic acid IUPAC Name: 2-[2,5-dimethyl-1-[4-(3-methylbutoxy)phenyl]pyrrol-3-yl]acetic acid Traditional Name: 2-[1-(4-isoamoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OCCC(C)C)C)CC(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OCCC(C)C)C)CC(=O)O

InChI

InChI=1S/C19H25NO3/c1-13(2)9-10-23-18-7-5-17(6-8-18)20-14(3)11-16(15(20)4)12-19(21)22/h5-8,11,13H,9-10,12H2,1-4H3,(H,21,22)