N-[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[1-(3-methoxyphenyl)sulfonyl-4-piperidyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[1-(3-methoxyphenyl)sulfonyl-4-piperidinyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[1-(3-methoxyphenyl)sulfonyl-4-piperidyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C22H27N3O4S MolecularWeight: 429.53248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)NC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)NC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H27N3O4S/c1-29-20-7-4-8-21(15-20)30(27,28)25-13-10-19(11-14-25)23-22(26)24-12-9-17-5-2-3-6-18(17)16-24/h2-8,15,19H,9-14,16H2,1H3,(H,23,26)