5-(3-ethanoyl-2,5-dimethyl-pyrrol-1-yl)-2-pyrrolidin-1-yl-benzoic acid

Systemtic Name: 5-(3-ethanoyl-2,5-dimethyl-pyrrol-1-yl)-2-pyrrolidin-1-yl-benzoic acid Openeye Name: 5-(3-acetyl-2,5-dimethyl-pyrrol-1-yl)-2-pyrrolidin-1-yl-benzoic acid CAS Name: 5-(3-acetyl-2,5-dimethyl-1-pyrrolyl)-2-(1-pyrrolidinyl)benzoic acid IUPAC Name: 5-(3-acetyl-2,5-dimethylpyrrol-1-yl)-2-pyrrolidin-1-ylbenzoic acid Traditional Name: 5-(3-acetyl-2,5-dimethyl-pyrrol-1-yl)-2-pyrrolidino-benzoic acid Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCCC3)C(=O)O)C)C(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCCC3)C(=O)O)C)C(=O)C

InChI

InChI=1S/C19H22N2O3/c1-12-10-16(14(3)22)13(2)21(12)15-6-7-18(17(11-15)19(23)24)20-8-4-5-9-20/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,23,24)