2-(4-phenylpiperazin-1-yl)ethyl 1-(4-iodophenyl)cyclopentane-1-carboxylate hydrochloride

Systemtic Name: 2-(4-phenylpiperazin-1-yl)ethyl 1-(4-iodophenyl)cyclopentane-1-carboxylate hydrochloride Openeye Name: 2-(4-phenylpiperazin-1-yl)ethyl 1-(4-iodophenyl)cyclopentanecarboxylate hydrochloride CAS Name: 1-(4-iodophenyl)-1-cyclopentanecarboxylic acid 2-(4-phenyl-1-piperazinyl)ethyl ester hydrochloride IUPAC Name: 2-(4-phenylpiperazin-1-yl)ethyl 1-(4-iodophenyl)cyclopentane-1-carboxylate hydrochloride Traditional Name: 1-(4-iodophenyl)cyclopentanecarboxylic acid 2-(4-phenylpiperazino)ethyl ester hydrochloride Formula: C24H30ClIN2O2 MolecularWeight: 540.86467

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=C(C=C2)I)C(=O)OCCN3CCN(CC3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CCC(C1)(C2=CC=C(C=C2)I)C(=O)OCCN3CCN(CC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C24H29IN2O2.ClH/c25-21-10-8-20(9-11-21)24(12-4-5-13-24)23(28)29-19-18-26-14-16-27(17-15-26)22-6-2-1-3-7-22;/h1-3,6-11H,4-5,12-19H2;1H