propyl 4-[2-[4-(4-methylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: propyl 4-[2-[4-(4-methylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: propyl 4-[2-[4-(4-methylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-(4-methylsulfonylphenyl)-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid propyl ester IUPAC Name: propyl 4-[2-[4-(4-methylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-(4-mesylphenyl)piperazino]ethyl]piperidine-1-carboxylic acid propyl ester Formula: C22H35N3O4S MolecularWeight: 437.596

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)N1CCC(CC1)CCN2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCOC(=O)N1CCC(CC1)CCN2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H35N3O4S/c1-3-18-29-22(26)25-12-9-19(10-13-25)8-11-23-14-16-24(17-15-23)20-4-6-21(7-5-20)30(2,27)28/h4-7,19H,3,8-18H2,1-2H3