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2,3-bis(1,4,7,10-tetrazacyclododec-1-yl)butanedioic acid

2,3-bis(1,4,7,10-tetrazacyclododec-1-yl)butanedioic acid

Systemtic Name:2,3-bis(1,4,7,10-tetrazacyclododec-1-yl)butanedioic acid
Openeye Name:2,3-bis(1,4,7,10-tetrazacyclododec-1-yl)butanedioic acid
CAS Name:2,3-bis(1,4,7,10-tetrazacyclododec-1-yl)butanedioic acid
IUPAC Name:2,3-bis(1,4,7,10-tetrazacyclododec-1-yl)butanedioic acid
Traditional Name:2,3-bis(1,4,7,10-tetrazacyclododec-1-yl)succinic acid
Formula: C20H42N8O4
MolecularWeight: 458.59868
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(CCNCCN1)C(C(C(=O)O)N2CCNCCNCCNCC2)C(=O)O


Isomeric SMILES

C1CNCCN(CCNCCN1)C(C(C(=O)O)N2CCNCCNCCNCC2)C(=O)O


InChI

InChI=1S/C20H42N8O4/c29-19(30)17(27-13-9-23-5-1-21-2-6-24-10-14-27)18(20(31)32)28-15-11-25-7-3-22-4-8-26-12-16-28/h17-18,21-26H,1-16H2,(H,29,30)(H,31,32)


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