1-(2,5-dimethylphenyl)-5-[(1R)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]-6-oxidanyl-pyrimidine-2,4-dione

Systemtic Name: 1-(2,5-dimethylphenyl)-5-[(1R)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 1-(2,5-dimethylphenyl)-6-hydroxy-5-[(1R)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]pyrimidine-2,4-dione CAS Name: 1-(2,5-dimethylphenyl)-6-hydroxy-5-[(1R)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]pyrimidine-2,4-dione IUPAC Name: 1-(2,5-dimethylphenyl)-6-hydroxy-5-[(1R)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]pyrimidine-2,4-dione Traditional Name: 1-(2,5-dimethylphenyl)-6-hydroxy-5-[(1R)-6-methoxy-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium-1-yl]pyrimidine-2,4-quinone Formula: C24H25N4O4+ MolecularWeight: 433.4797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=C(C(=O)NC2=O)C3C4=C(CC[NH2+]3)C5=C(N4)C=CC(=C5)OC)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=C(C(=O)NC2=O)[C@@H]3C4=C(CC[NH2+]3)C5=C(N4)C=CC(=C5)OC)O

InChI

InChI=1S/C24H24N4O4/c1-12-4-5-13(2)18(10-12)28-23(30)19(22(29)27-24(28)31)21-20-15(8-9-25-21)16-11-14(32-3)6-7-17(16)26-20/h4-7,10-11,21,25-26,30H,8-9H2,1-3H3,(H,27,29,31)/p+1/t21-/m1/s1