(1-methylcyclopropyl) 4-[2-chloranyl-4-[(4-methylsulfonylpiperazin-1-yl)methyl]phenoxy]piperidine-1-carboxylate

Systemtic Name: (1-methylcyclopropyl) 4-[2-chloranyl-4-[(4-methylsulfonylpiperazin-1-yl)methyl]phenoxy]piperidine-1-carboxylate Openeye Name: (1-methylcyclopropyl) 4-[2-chloro-4-[(4-methylsulfonylpiperazin-1-yl)methyl]phenoxy]piperidine-1-carboxylate CAS Name: 4-[2-chloro-4-[(4-methylsulfonyl-1-piperazinyl)methyl]phenoxy]-1-piperidinecarboxylic acid (1-methylcyclopropyl) ester IUPAC Name: (1-methylcyclopropyl) 4-[2-chloro-4-[(4-methylsulfonylpiperazin-1-yl)methyl]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[2-chloro-4-[(4-mesylpiperazino)methyl]phenoxy]piperidine-1-carboxylic acid (1-methylcyclopropyl) ester Formula: C22H32ClN3O5S MolecularWeight: 486.02458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1)OC(=O)N2CCC(CC2)OC3=C(C=C(C=C3)CN4CCN(CC4)S(=O)(=O)C)Cl

Isomeric SMILES

CC1(CC1)OC(=O)N2CCC(CC2)OC3=C(C=C(C=C3)CN4CCN(CC4)S(=O)(=O)C)Cl

InChI

InChI=1S/C22H32ClN3O5S/c1-22(7-8-22)31-21(27)25-9-5-18(6-10-25)30-20-4-3-17(15-19(20)23)16-24-11-13-26(14-12-24)32(2,28)29/h3-4,15,18H,5-14,16H2,1-2H3