N-[3-[8-[3-[dioxidanyl(methyl)amino]propyl]-5-[3-[ethanoyl(oxidanyl)amino]propyl]-3,6,9,12,15,18-hexakis(oxidanylidene)-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-oxidanyl-ethanamide

Systemtic Name: N-[3-[8-[3-[dioxidanyl(methyl)amino]propyl]-5-[3-[ethanoyl(oxidanyl)amino]propyl]-3,6,9,12,15,18-hexakis(oxidanylidene)-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-oxidanyl-ethanamide Openeye Name: N-[3-[5-[3-[acetyl(hydroxy)amino]propyl]-8-[3-[hydroperoxy(methyl)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-hydroxy-acetamide CAS Name: N-[3-[5-[3-[acetyl(hydroxy)amino]propyl]-8-[3-[hydroperoxy(methyl)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-hydroxyacetamide IUPAC Name: N-[3-[5-[3-[acetyl(hydroxy)amino]propyl]-8-[3-[hydroperoxy(methyl)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-hydroxyacetamide Traditional Name: N-[3-[5-[3-[acetyl(hydroxy)amino]propyl]-8-[3-[hydroperoxy(methyl)amino]propyl]-3,6,9,12,15,18-hexaketo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-hydroxy-acetamide Formula: C26H45N9O12 MolecularWeight: 675.6886

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCC1C(=O)NC(C(=O)NC(C(=O)NCC(=O)NCC(=O)NCC(=O)N1)CCCN(C)OO)CCCN(C(=O)C)O)O

Isomeric SMILES

CC(=O)N(CCCC1C(=O)NC(C(=O)NC(C(=O)NCC(=O)NCC(=O)NCC(=O)N1)CCCN(C)OO)CCCN(C(=O)C)O)O

InChI

InChI=1S/C26H45N9O12/c1-16(36)34(44)11-5-8-19-25(42)32-20(9-6-12-35(45)17(2)37)26(43)31-18(7-4-10-33(3)47-46)24(41)29-14-22(39)27-13-21(38)28-15-23(40)30-19/h18-20,44-46H,4-15H2,1-3H3,(H,27,39)(H,28,38)(H,29,41)(H,30,40)(H,31,43)(H,32,42)