propan-2-yl 4-[3-[ethyl-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)amino]propyl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[3-[ethyl-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)amino]propyl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[3-[ethyl-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)amino]propyl]piperidine-1-carboxylate CAS Name: 4-[3-[ethyl-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)amino]propyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-[ethyl-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)amino]propyl]piperidine-1-carboxylate Traditional Name: 4-[3-[ethyl-(2-mesyl-3,4-dihydro-1H-isoquinolin-6-yl)amino]propyl]piperidine-1-carboxylic acid isopropyl ester Formula: C24H39N3O4S MolecularWeight: 465.64916

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC1CCN(CC1)C(=O)OC(C)C)C2=CC3=C(CN(CC3)S(=O)(=O)C)C=C2

Isomeric SMILES

CCN(CCCC1CCN(CC1)C(=O)OC(C)C)C2=CC3=C(CN(CC3)S(=O)(=O)C)C=C2

InChI

InChI=1S/C24H39N3O4S/c1-5-25(13-6-7-20-10-14-26(15-11-20)24(28)31-19(2)3)23-9-8-22-18-27(32(4,29)30)16-12-21(22)17-23/h8-9,17,19-20H,5-7,10-16,18H2,1-4H3