2-[4-azanyl-5,6-dimethyl-7-(2-methylpropyl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]ethanol

Systemtic Name: 2-[4-azanyl-5,6-dimethyl-7-(2-methylpropyl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]ethanol Openeye Name: 2-(4-amino-7-isobutyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-3-yl)ethanol CAS Name: 2-[4-amino-5,6-dimethyl-7-(2-methylpropyl)-3-pyrrolo[2,3-d]pyrimidin-3-iumyl]ethanol IUPAC Name: 2-[4-amino-5,6-dimethyl-7-(2-methylpropyl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]ethanol Traditional Name: 2-(4-amino-7-isobutyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-3-ium-3-yl)ethanol Formula: C14H23N4O+ MolecularWeight: 263.35862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=[N+](C=N2)CCO)N)CC(C)C)C

Isomeric SMILES

CC1=C(N(C2=C1C(=[N+](C=N2)CCO)N)CC(C)C)C

InChI

InChI=1S/C14H22N4O/c1-9(2)7-18-11(4)10(3)12-13(15)17(5-6-19)8-16-14(12)18/h8-9,15,19H,5-7H2,1-4H3/p+1