2-azanyl-4-chloranyl-7-[(5-methoxy-4,6-dimethyl-1-oxidanidyl-pyridin-1-ium-3-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one

Systemtic Name: 2-azanyl-4-chloranyl-7-[(5-methoxy-4,6-dimethyl-1-oxidanidyl-pyridin-1-ium-3-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Openeye Name: 2-amino-4-chloro-7-[(5-methoxy-4,6-dimethyl-1-oxido-pyridin-1-ium-3-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one CAS Name: 2-amino-4-chloro-7-[(5-methoxy-4,6-dimethyl-1-oxido-3-pyridin-1-iumyl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one IUPAC Name: 2-amino-4-chloro-7-[(5-methoxy-4,6-dimethyl-1-oxidopyridin-1-ium-3-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Traditional Name: 2-amino-4-chloro-7-[(5-methoxy-4,6-dimethyl-1-oxido-pyridin-1-ium-3-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Formula: C15H16ClN5O3 MolecularWeight: 349.77224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](C=C1CN2CC(=O)C3=C2N=C(N=C3Cl)N)[O-])C)OC

Isomeric SMILES

CC1=C(C(=[N+](C=C1CN2CC(=O)C3=C2N=C(N=C3Cl)N)[O-])C)OC

InChI

InChI=1S/C15H16ClN5O3/c1-7-9(5-21(23)8(2)12(7)24-3)4-20-6-10(22)11-13(16)18-15(17)19-14(11)20/h5H,4,6H2,1-3H3,(H2,17,18,19)