N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propan-2-yloxy-benzamide

Systemtic Name: N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propan-2-yloxy-benzamide Openeye Name: N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-isopropoxy-benzamide CAS Name: N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propan-2-yloxybenzamide IUPAC Name: N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propan-2-yloxybenzamide Traditional Name: N-(2-esyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-isopropoxy-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)OC(C)C

InChI

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