2-[8-azanyl-6-indol-1-yl-2-oxidanyl-5,8-bis(oxidanylidene)-3-(pyridin-3-ylmethyl)octyl]-N-tert-butyl-benzamide

Systemtic Name: 2-[8-azanyl-6-indol-1-yl-2-oxidanyl-5,8-bis(oxidanylidene)-3-(pyridin-3-ylmethyl)octyl]-N-tert-butyl-benzamide Openeye Name: 2-[8-amino-2-hydroxy-6-indol-1-yl-5,8-dioxo-3-(3-pyridylmethyl)octyl]-N-tert-butyl-benzamide CAS Name: 2-[8-amino-2-hydroxy-6-(1-indolyl)-5,8-dioxo-3-(3-pyridinylmethyl)octyl]-N-tert-butylbenzamide IUPAC Name: 2-[8-amino-2-hydroxy-6-indol-1-yl-5,8-dioxo-3-(pyridin-3-ylmethyl)octyl]-N-tert-butylbenzamide Traditional Name: 2-[8-amino-2-hydroxy-6-indol-1-yl-5,8-diketo-3-(3-pyridylmethyl)octyl]-N-tert-butyl-benzamide Formula: C33H38N4O4 MolecularWeight: 554.67922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=CC=C1CC(C(CC2=CN=CC=C2)CC(=O)C(CC(=O)N)N3C=CC4=CC=CC=C43)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=CC=C1CC(C(CC2=CN=CC=C2)CC(=O)C(CC(=O)N)N3C=CC4=CC=CC=C43)O

InChI

InChI=1S/C33H38N4O4/c1-33(2,3)36-32(41)26-12-6-4-11-24(26)18-29(38)25(17-22-9-8-15-35-21-22)19-30(39)28(20-31(34)40)37-16-14-23-10-5-7-13-27(23)37/h4-16,21,25,28-29,38H,17-20H2,1-3H3,(H2,34,40)(H,36,41)