2-diethylaminoethyl 4-[2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]ethyl]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]ethyl]benzoate Openeye Name: 2-diethylaminoethyl 4-[2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]ethyl]benzoate CAS Name: 4-[2-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]ethyl]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]ethyl]benzoate Traditional Name: 4-[2-[4-(2-chlorobenzyl)piperazino]ethyl]benzoic acid 2-diethylaminoethyl ester Formula: C26H36ClN3O2 MolecularWeight: 458.03594

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)CCN2CCN(CC2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)CCN2CCN(CC2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C26H36ClN3O2/c1-3-28(4-2)19-20-32-26(31)23-11-9-22(10-12-23)13-14-29-15-17-30(18-16-29)21-24-7-5-6-8-25(24)27/h5-12H,3-4,13-21H2,1-2H3