1,9,13-trimethyl-8-(6-oxidanyltridecyl)-1,5,9,13-tetrazacycloheptadecan-6-one

Systemtic Name: 1,9,13-trimethyl-8-(6-oxidanyltridecyl)-1,5,9,13-tetrazacycloheptadecan-6-one Openeye Name: 8-(6-hydroxytridecyl)-1,9,13-trimethyl-1,5,9,13-tetrazacycloheptadecan-6-one CAS Name: 8-(6-hydroxytridecyl)-1,9,13-trimethyl-1,5,9,13-tetrazacycloheptadecan-6-one IUPAC Name: 8-(6-hydroxytridecyl)-1,9,13-trimethyl-1,5,9,13-tetrazacycloheptadecan-6-one Traditional Name: 8-(6-hydroxytridecyl)-1,9,13-trimethyl-1,5,9,13-tetrazacycloheptadecan-6-one Formula: C29H60N4O2 MolecularWeight: 496.8123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCCCC1CC(=O)NCCCN(CCCCN(CCCN1C)C)C)O

Isomeric SMILES

CCCCCCCC(CCCCCC1CC(=O)NCCCN(CCCCN(CCCN1C)C)C)O

InChI

InChI=1S/C29H60N4O2/c1-5-6-7-8-11-18-28(34)19-12-9-10-17-27-26-29(35)30-20-15-23-31(2)21-13-14-22-32(3)24-16-25-33(27)4/h27-28,34H,5-26H2,1-4H3,(H,30,35)