5-(2,5-dimethylpyrrol-1-yl)-2-pyrrolidin-1-yl-benzoic acid

Systemtic Name: 5-(2,5-dimethylpyrrol-1-yl)-2-pyrrolidin-1-yl-benzoic acid Openeye Name: 5-(2,5-dimethylpyrrol-1-yl)-2-pyrrolidin-1-yl-benzoic acid CAS Name: 5-(2,5-dimethyl-1-pyrrolyl)-2-(1-pyrrolidinyl)benzoic acid IUPAC Name: 5-(2,5-dimethylpyrrol-1-yl)-2-pyrrolidin-1-ylbenzoic acid Traditional Name: 5-(2,5-dimethylpyrrol-1-yl)-2-pyrrolidino-benzoic acid Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O2/c1-12-5-6-13(2)19(12)14-7-8-16(15(11-14)17(20)21)18-9-3-4-10-18/h5-8,11H,3-4,9-10H2,1-2H3,(H,20,21)