3-methyl-1-(2-oxidanylidene-1,4,7,10-tetrazacyclododec-1-yl)-1,4,7,10-tetrazacyclododecan-2-one

Systemtic Name: 3-methyl-1-(2-oxidanylidene-1,4,7,10-tetrazacyclododec-1-yl)-1,4,7,10-tetrazacyclododecan-2-one Openeye Name: 3-methyl-1-(2-oxo-1,4,7,10-tetrazacyclododec-1-yl)-1,4,7,10-tetrazacyclododecan-2-one CAS Name: 3-methyl-1-(2-oxo-1,4,7,10-tetrazacyclododec-1-yl)-1,4,7,10-tetrazacyclododecan-2-one IUPAC Name: 3-methyl-1-(2-oxo-1,4,7,10-tetrazacyclododec-1-yl)-1,4,7,10-tetrazacyclododecan-2-one Traditional Name: 1-(2-keto-1,4,7,10-tetrazacyclododec-1-yl)-3-methyl-1,4,7,10-tetrazacyclododecan-2-one Formula: C17H36N8O2 MolecularWeight: 384.52014

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CCNCCNCCN1)N2CCNCCNCCNCC2=O

Isomeric SMILES

CC1C(=O)N(CCNCCNCCN1)N2CCNCCNCCNCC2=O

InChI

InChI=1S/C17H36N8O2/c1-15-17(27)25(13-11-21-5-3-19-8-9-23-15)24-12-10-20-4-2-18-6-7-22-14-16(24)26/h15,18-23H,2-14H2,1H3