2-(4-ethoxyphenyl)sulfonyl-N-(4-piperidin-1-ylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)sulfonyl-N-(4-piperidin-1-ylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(4-ethoxyphenyl)sulfonyl-N-[4-(1-piperidyl)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(4-ethoxyphenyl)sulfonyl-N-[4-(1-piperidinyl)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(4-ethoxyphenyl)sulfonyl-N-(4-piperidin-1-ylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(4-piperidinophenyl)-2-p-phenetylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C29H33N3O4S MolecularWeight: 519.65502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=CC=C(C=C4)N5CCCCC5

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=CC=C(C=C4)N5CCCCC5

InChI

InChI=1S/C29H33N3O4S/c1-2-36-26-14-16-27(17-15-26)37(34,35)32-21-23-9-5-4-8-22(23)20-28(32)29(33)30-24-10-12-25(13-11-24)31-18-6-3-7-19-31/h4-5,8-17,28H,2-3,6-7,18-21H2,1H3,(H,30,33)