6-[(5-azanyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)methyl]-5-chloranyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(5-azanyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)methyl]-5-chloranyl-1H-pyrimidin-4-one Openeye Name: 6-[(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)methyl]-5-chloro-1H-pyrimidin-4-one CAS Name: 6-[(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)methyl]-5-chloro-1H-pyrimidin-4-one IUPAC Name: 6-[(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)methyl]-5-chloro-1H-pyrimidin-4-one Traditional Name: 6-[(2-amino-1-pyrrolin-1-ium-1-yl)methyl]-5-chloro-1H-pyrimidin-4-one Formula: C9H12ClN4O+ MolecularWeight: 227.67078

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[N+](C1)CC2=C(C(=O)N=CN2)Cl)N

Isomeric SMILES

C1CC(=[N+](C1)CC2=C(C(=O)N=CN2)Cl)N

InChI

InChI=1S/C9H11ClN4O/c10-8-6(12-5-13-9(8)15)4-14-3-1-2-7(14)11/h5,11H,1-4H2,(H,12,13,15)/p+1