2-[3-[3-chloranyl-1-(1-oxidanyl-2,3-dihydro-1H-inden-5-yl)pyrrolidin-2-yl]propyl]benzoic acid

Systemtic Name: 2-[3-[3-chloranyl-1-(1-oxidanyl-2,3-dihydro-1H-inden-5-yl)pyrrolidin-2-yl]propyl]benzoic acid Openeye Name: 2-[3-[3-chloro-1-(1-hydroxyindan-5-yl)pyrrolidin-2-yl]propyl]benzoic acid CAS Name: 2-[3-[3-chloro-1-(1-hydroxy-2,3-dihydro-1H-inden-5-yl)-2-pyrrolidinyl]propyl]benzoic acid IUPAC Name: 2-[3-[3-chloro-1-(1-hydroxy-2,3-dihydro-1H-inden-5-yl)pyrrolidin-2-yl]propyl]benzoic acid Traditional Name: 2-[3-[3-chloro-1-(1-hydroxyindan-5-yl)pyrrolidin-2-yl]propyl]benzoic acid Formula: C23H26ClNO3 MolecularWeight: 399.91044

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1O)C=CC(=C2)N3CCC(C3CCCC4=CC=CC=C4C(=O)O)Cl

Isomeric SMILES

C1CC2=C(C1O)C=CC(=C2)N3CCC(C3CCCC4=CC=CC=C4C(=O)O)Cl

InChI

InChI=1S/C23H26ClNO3/c24-20-12-13-25(17-9-10-18-16(14-17)8-11-22(18)26)21(20)7-3-5-15-4-1-2-6-19(15)23(27)28/h1-2,4,6,9-10,14,20-22,26H,3,5,7-8,11-13H2,(H,27,28)