N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-9H-xanthene-9-carboxamide Openeye Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-9H-xanthene-9-carboxamide CAS Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-9H-xanthene-9-carboxamide Traditional Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-9H-xanthene-9-carboxamide Formula: C28H30N2O6S MolecularWeight: 522.6126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)CCCNC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)CCCNC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)OC

InChI

InChI=1S/C28H30N2O6S/c1-34-25-16-19-12-14-30(18-20(19)17-26(25)35-2)37(32,33)15-7-13-29-28(31)27-21-8-3-5-10-23(21)36-24-11-6-4-9-22(24)27/h3-6,8-11,16-17,27H,7,12-15,18H2,1-2H3,(H,29,31)