3-methoxy-N-methylsulfonyl-4-[[2-(octanoylamino)indol-1-yl]methyl]benzamide

Systemtic Name: 3-methoxy-N-methylsulfonyl-4-[[2-(octanoylamino)indol-1-yl]methyl]benzamide Openeye Name: 3-methoxy-N-methylsulfonyl-4-[[2-(octanoylamino)indol-1-yl]methyl]benzamide CAS Name: 3-methoxy-N-methylsulfonyl-4-[[2-(1-oxooctylamino)-1-indolyl]methyl]benzamide IUPAC Name: 3-methoxy-N-methylsulfonyl-4-[[2-(octanoylamino)indol-1-yl]methyl]benzamide Traditional Name: 4-[[2-(caprylylamino)indol-1-yl]methyl]-N-mesyl-3-methoxy-benzamide Formula: C26H33N3O5S MolecularWeight: 499.62232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC2=CC=CC=C2N1CC3=C(C=C(C=C3)C(=O)NS(=O)(=O)C)OC

Isomeric SMILES

CCCCCCCC(=O)NC1=CC2=CC=CC=C2N1CC3=C(C=C(C=C3)C(=O)NS(=O)(=O)C)OC

InChI

InChI=1S/C26H33N3O5S/c1-4-5-6-7-8-13-25(30)27-24-17-19-11-9-10-12-22(19)29(24)18-21-15-14-20(16-23(21)34-2)26(31)28-35(3,32)33/h9-12,14-17H,4-8,13,18H2,1-3H3,(H,27,30)(H,28,31)