N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenoxy-propanamide

Systemtic Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenoxy-propanamide Openeye Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenoxy-propanamide CAS Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenoxypropanamide IUPAC Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenoxypropanamide Traditional Name: N-[2-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-2-phenoxy-propionamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCS(=O)(=O)N1CCC2=C(C1)C=CC(=C2)OC)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NCCS(=O)(=O)N1CCC2=C(C1)C=CC(=C2)OC)OC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O5S/c1-16(28-19-6-4-3-5-7-19)21(24)22-11-13-29(25,26)23-12-10-17-14-20(27-2)9-8-18(17)15-23/h3-9,14,16H,10-13,15H2,1-2H3,(H,22,24)