2,7-dimethyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride

Systemtic Name: 2,7-dimethyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Openeye Name: 2,7-dimethyl-6-phenyl-4-(1-piperidyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride CAS Name: 2,7-dimethyl-6-phenyl-4-(1-piperidinyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride IUPAC Name: 2,7-dimethyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Traditional Name: 2,7-dimethyl-6-phenyl-4-piperidino-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Formula: C19H23ClN4 MolecularWeight: 342.86572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH2+]C2=C1N=C(N=C2N3CCCCC3)C)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC1=C([NH2+]C2=C1N=C(N=C2N3CCCCC3)C)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C19H22N4.ClH/c1-13-16(15-9-5-3-6-10-15)22-18-17(13)20-14(2)21-19(18)23-11-7-4-8-12-23;/h3,5-6,9-10,22H,4,7-8,11-12H2,1-2H3;1H