10-(phenylmethyl)-1,4,7,10-tetrazacyclododecane-1,4,7-tricarbaldehyde

Systemtic Name: 10-(phenylmethyl)-1,4,7,10-tetrazacyclododecane-1,4,7-tricarbaldehyde Openeye Name: 10-benzyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarbaldehyde CAS Name: 10-(phenylmethyl)-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxaldehyde IUPAC Name: 10-benzyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarbaldehyde Traditional Name: 10-benzyl-1,4,7,10-tetrazacyclododecane-1,4,7-tricarbaldehyde Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(CCN(CCN1CC2=CC=CC=C2)C=O)C=O)C=O

Isomeric SMILES

C1CN(CCN(CCN(CCN1CC2=CC=CC=C2)C=O)C=O)C=O

InChI

InChI=1S/C18H26N4O3/c23-15-20-8-6-19(14-18-4-2-1-3-5-18)7-9-21(16-24)11-13-22(17-25)12-10-20/h1-5,15-17H,6-14H2