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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

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