2-(cyclohexylamino)-7,10-dimethyl-5-oxidanidyl-benzo[g]pteridin-5-ium-4-one

Systemtic Name: 2-(cyclohexylamino)-7,10-dimethyl-5-oxidanidyl-benzo[g]pteridin-5-ium-4-one Openeye Name: 2-(cyclohexylamino)-7,10-dimethyl-5-oxido-benzo[g]pteridin-5-ium-4-one CAS Name: 2-(cyclohexylamino)-7,10-dimethyl-5-oxido-4-benzo[g]pteridin-5-iumone IUPAC Name: 2-(cyclohexylamino)-7,10-dimethyl-5-oxidobenzo[g]pteridin-5-ium-4-one Traditional Name: 2-(cyclohexylamino)-7,10-dimethyl-5-oxido-benzo[g]pteridin-5-ium-4-one Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=NC(=NC(=O)C3=[N+]2[O-])NC4CCCCC4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=NC(=NC(=O)C3=[N+]2[O-])NC4CCCCC4)C

InChI

InChI=1S/C18H21N5O2/c1-11-8-9-13-14(10-11)23(25)15-16(22(13)2)20-18(21-17(15)24)19-12-6-4-3-5-7-12/h8-10,12H,3-7H2,1-2H3,(H,19,21,24)