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

Systemtic Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]propanoate Openeye Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]propanoate CAS Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]propanoate IUPAC Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]propanoate Traditional Name: 3-[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]propionate Formula: C17H20NO2- MolecularWeight: 270.3462

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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)/p-1