3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(3-methylphenoxy)ethyl]benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(3-methylphenoxy)ethyl]benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(3-methylphenoxy)ethyl]benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(3-methylphenoxy)ethyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(3-methylphenoxy)ethyl]benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(3-methylphenoxy)ethyl]benzamide Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H26N2O4S/c1-19-6-4-10-23(16-19)31-15-13-26-25(28)21-9-5-11-24(17-21)32(29,30)27-14-12-20-7-2-3-8-22(20)18-27/h2-11,16-17H,12-15,18H2,1H3,(H,26,28)