3-pyrrolidin-1-ylpropyl 2,2-bis(4-bromophenyl)-2-oxidanyl-ethanoate hydrochloride

Systemtic Name: 3-pyrrolidin-1-ylpropyl 2,2-bis(4-bromophenyl)-2-oxidanyl-ethanoate hydrochloride Openeye Name: 3-pyrrolidin-1-ylpropyl 2,2-bis(4-bromophenyl)-2-hydroxy-acetate hydrochloride CAS Name: 2,2-bis(4-bromophenyl)-2-hydroxyacetic acid 3-(1-pyrrolidinyl)propyl ester hydrochloride IUPAC Name: 3-pyrrolidin-1-ylpropyl 2,2-bis(4-bromophenyl)-2-hydroxyacetate hydrochloride Traditional Name: 2,2-bis(4-bromophenyl)-2-hydroxy-acetic acid 3-pyrrolidinopropyl ester hydrochloride Formula: C21H24Br2ClNO3 MolecularWeight: 533.68116

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC(=O)C(C2=CC=C(C=C2)Br)(C3=CC=C(C=C3)Br)O.Cl

Isomeric SMILES

C1CCN(C1)CCCOC(=O)C(C2=CC=C(C=C2)Br)(C3=CC=C(C=C3)Br)O.Cl

InChI

InChI=1S/C21H23Br2NO3.ClH/c22-18-8-4-16(5-9-18)21(26,17-6-10-19(23)11-7-17)20(25)27-15-3-14-24-12-1-2-13-24;/h4-11,26H,1-3,12-15H2;1H