(2-hydroxyphenyl)-[7-(2-hydroxyphenyl)carbonyl-1,4,7,10-tetrazacyclododec-1-yl]methanone

Systemtic Name: (2-hydroxyphenyl)-[7-(2-hydroxyphenyl)carbonyl-1,4,7,10-tetrazacyclododec-1-yl]methanone Openeye Name: [7-(2-hydroxybenzoyl)-1,4,7,10-tetrazacyclododec-1-yl]-(2-hydroxyphenyl)methanone CAS Name: (2-hydroxyphenyl)-[7-[(2-hydroxyphenyl)-oxomethyl]-1,4,7,10-tetrazacyclododec-1-yl]methanone IUPAC Name: [7-(2-hydroxybenzoyl)-1,4,7,10-tetrazacyclododec-1-yl]-(2-hydroxyphenyl)methanone Traditional Name: (2-hydroxyphenyl)-(7-salicyloyl-1,4,7,10-tetrazacyclododec-1-yl)methanone Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCNCCN(CCN1)C(=O)C2=CC=CC=C2O)C(=O)C3=CC=CC=C3O

Isomeric SMILES

C1CN(CCNCCN(CCN1)C(=O)C2=CC=CC=C2O)C(=O)C3=CC=CC=C3O

InChI

InChI=1S/C22H28N4O4/c27-19-7-3-1-5-17(19)21(29)25-13-9-23-11-15-26(16-12-24-10-14-25)22(30)18-6-2-4-8-20(18)28/h1-8,23-24,27-28H,9-16H2