9-[(2-methoxyphenyl)methyl]-1,5,9-triazacyclododecane-2,4-dione

Systemtic Name: 9-[(2-methoxyphenyl)methyl]-1,5,9-triazacyclododecane-2,4-dione Openeye Name: 9-[(2-methoxyphenyl)methyl]-1,5,9-triazacyclododecane-2,4-dione CAS Name: 9-[(2-methoxyphenyl)methyl]-1,5,9-triazacyclododecane-2,4-dione IUPAC Name: 9-[(2-methoxyphenyl)methyl]-1,5,9-triazacyclododecane-2,4-dione Traditional Name: 9-o-anisyl-1,5,9-triazacyclododecane-2,4-quinone Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2CCCNC(=O)CC(=O)NCCC2

Isomeric SMILES

COC1=CC=CC=C1CN2CCCNC(=O)CC(=O)NCCC2

InChI

InChI=1S/C17H25N3O3/c1-23-15-7-3-2-6-14(15)13-20-10-4-8-18-16(21)12-17(22)19-9-5-11-20/h2-3,6-7H,4-5,8-13H2,1H3,(H,18,21)(H,19,22)