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

Systemtic Name: propan-2-yl 4-[2-[4-(4-methylsulfonylphenyl)piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C22H35N3O4S MolecularWeight: 437.596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35N3O4S/c1-18(2)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(3,27)28/h4-7,18-19H,8-17H2,1-3H3