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

Systemtic Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]propanoic acid Openeye Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]propanoic acid CAS Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]propanoic acid Traditional Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]propionic acid Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO2/c1-11-7-12(2)9-16(8-11)18-13(3)10-15(14(18)4)5-6-17(19)20/h7-10H,5-6H2,1-4H3,(H,19,20)