N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidinyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)-4-piperidyl]-2-esyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C24H30ClN3O3S MolecularWeight: 476.0313

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3CCN(CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3CCN(CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H30ClN3O3S/c1-2-32(30,31)28-17-20-6-4-3-5-19(20)15-23(28)24(29)26-22-11-13-27(14-12-22)16-18-7-9-21(25)10-8-18/h3-10,22-23H,2,11-17H2,1H3,(H,26,29)