2-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanoic acid Openeye Name: 2-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid CAS Name: 2-[1-(3,5-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]acetic acid IUPAC Name: 2-[1-(3,5-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]acetic acid Traditional Name: 2-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=CC(=C2C)CC(=O)O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=CC(=C2C)CC(=O)O)C)C

InChI

InChI=1S/C16H19NO2/c1-10-5-11(2)7-15(6-10)17-12(3)8-14(13(17)4)9-16(18)19/h5-8H,9H2,1-4H3,(H,18,19)