2-(1-benzofuran-2-ylmethylamino)-N-[1-(cyclohexylmethyl)-2-oxidanyl-indol-3-yl]-2-methyl-propanamide

Systemtic Name: 2-(1-benzofuran-2-ylmethylamino)-N-[1-(cyclohexylmethyl)-2-oxidanyl-indol-3-yl]-2-methyl-propanamide Openeye Name: 2-(benzofuran-2-ylmethylamino)-N-[1-(cyclohexylmethyl)-2-hydroxy-indol-3-yl]-2-methyl-propanamide CAS Name: 2-(2-benzofuranylmethylamino)-N-[1-(cyclohexylmethyl)-2-hydroxy-3-indolyl]-2-methylpropanamide IUPAC Name: 2-(1-benzofuran-2-ylmethylamino)-N-[1-(cyclohexylmethyl)-2-hydroxyindol-3-yl]-2-methylpropanamide Traditional Name: 2-(benzofuran-2-ylmethylamino)-N-[1-(cyclohexylmethyl)-2-hydroxy-indol-3-yl]-2-methyl-propionamide Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=C(N(C2=CC=CC=C21)CC3CCCCC3)O)NCC4=CC5=CC=CC=C5O4

Isomeric SMILES

CC(C)(C(=O)NC1=C(N(C2=CC=CC=C21)CC3CCCCC3)O)NCC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C28H33N3O3/c1-28(2,29-17-21-16-20-12-6-9-15-24(20)34-21)27(33)30-25-22-13-7-8-14-23(22)31(26(25)32)18-19-10-4-3-5-11-19/h6-9,12-16,19,29,32H,3-5,10-11,17-18H2,1-2H3,(H,30,33)