propan-2-yl 4-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)oxy]butyl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)oxy]butyl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)oxy]butyl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)oxy]butyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)oxy]butyl]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-mesyl-3,4-dihydro-1H-isoquinolin-6-yl)oxy]butyl]piperidine-1-carboxylic acid isopropyl ester Formula: C23H36N2O5S MolecularWeight: 452.60734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)CCCCOC2=CC3=C(CN(CC3)S(=O)(=O)C)C=C2

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)CCCCOC2=CC3=C(CN(CC3)S(=O)(=O)C)C=C2

InChI

InChI=1S/C23H36N2O5S/c1-18(2)30-23(26)24-12-9-19(10-13-24)6-4-5-15-29-22-8-7-21-17-25(31(3,27)28)14-11-20(21)16-22/h7-8,16,18-19H,4-6,9-15,17H2,1-3H3