2-(4-ethoxyphenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide

Systemtic Name: 2-(4-ethoxyphenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide Openeye Name: 2-(4-ethoxyphenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide CAS Name: 2-(4-ethoxyphenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide IUPAC Name: 2-(4-ethoxyphenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide Traditional Name: N-(2-esyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-p-phenetyl-acetamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)CC)C=C2

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)CC)C=C2

InChI

InChI=1S/C21H26N2O4S/c1-3-27-20-9-5-16(6-10-20)13-21(24)22-19-8-7-17-11-12-23(15-18(17)14-19)28(25,26)4-2/h5-10,14H,3-4,11-13,15H2,1-2H3,(H,22,24)