3-[4-azanyl-5,6-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]propan-1-ol

Systemtic Name: 3-[4-azanyl-5,6-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]propan-1-ol Openeye Name: 3-[4-amino-5,6-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]propan-1-ol CAS Name: 3-[4-amino-5,6-dimethyl-7-[2-(4-morpholin-4-iumyl)ethyl]-3-pyrrolo[2,3-d]pyrimidin-3-iumyl]-1-propanol IUPAC Name: 3-[4-amino-5,6-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]propan-1-ol Traditional Name: 3-[4-amino-5,6-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)pyrrolo[2,3-d]pyrimidin-3-ium-3-yl]propan-1-ol Formula: C17H29N5O2+2 MolecularWeight: 335.44446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=[N+](C=N2)CCCO)N)CC[NH+]3CCOCC3)C

Isomeric SMILES

CC1=C(N(C2=C1C(=[N+](C=N2)CCCO)N)CC[NH+]3CCOCC3)C

InChI

InChI=1S/C17H27N5O2/c1-13-14(2)22(6-5-20-7-10-24-11-8-20)17-15(13)16(18)21(12-19-17)4-3-9-23/h12,18,23H,3-11H2,1-2H3/p+2