10-[2-(2-methoxyethoxy)ethyl]-7,8-dimethyl-3-[2-oxidanylidene-2-(1,4,7,10-tetrazacyclododec-1-yl)ethyl]benzo[g]pteridine-2,4-dione

Systemtic Name: 10-[2-(2-methoxyethoxy)ethyl]-7,8-dimethyl-3-[2-oxidanylidene-2-(1,4,7,10-tetrazacyclododec-1-yl)ethyl]benzo[g]pteridine-2,4-dione Openeye Name: 10-[2-(2-methoxyethoxy)ethyl]-7,8-dimethyl-3-[2-oxo-2-(1,4,7,10-tetrazacyclododec-1-yl)ethyl]benzo[g]pteridine-2,4-dione CAS Name: 10-[2-(2-methoxyethoxy)ethyl]-7,8-dimethyl-3-[2-oxo-2-(1,4,7,10-tetrazacyclododec-1-yl)ethyl]benzo[g]pteridine-2,4-dione IUPAC Name: 10-[2-(2-methoxyethoxy)ethyl]-7,8-dimethyl-3-[2-oxo-2-(1,4,7,10-tetrazacyclododec-1-yl)ethyl]benzo[g]pteridine-2,4-dione Traditional Name: 3-[2-keto-2-(1,4,7,10-tetrazacyclododec-1-yl)ethyl]-10-[2-(2-methoxyethoxy)ethyl]-7,8-dimethyl-benzo[g]pteridine-2,4-quinone Formula: C27H40N8O5 MolecularWeight: 556.6571

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C3=NC(=O)N(C(=O)C3=N2)CC(=O)N4CCNCCNCCNCC4)CCOCCOC

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C3=NC(=O)N(C(=O)C3=N2)CC(=O)N4CCNCCNCCNCC4)CCOCCOC

InChI

InChI=1S/C27H40N8O5/c1-19-16-21-22(17-20(19)2)34(12-13-40-15-14-39-3)25-24(31-21)26(37)35(27(38)32-25)18-23(36)33-10-8-29-6-4-28-5-7-30-9-11-33/h16-17,28-30H,4-15,18H2,1-3H3