2-(3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-4-yl)-6-[(3S)-piperidin-1-ium-3-yl]-1H-pyrimidin-3-ium-4-one

Systemtic Name: 2-(3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-4-yl)-6-[(3S)-piperidin-1-ium-3-yl]-1H-pyrimidin-3-ium-4-one Openeye Name: 2-(3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-4-yl)-6-[(3S)-piperidin-1-ium-3-yl]-1H-pyrimidin-3-ium-4-one CAS Name: 2-(3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-4-yl)-6-[(3S)-3-piperidin-1-iumyl]-1H-pyrimidin-3-ium-4-one IUPAC Name: 2-(3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-4-yl)-6-[(3S)-piperidin-1-ium-3-yl]-1H-pyrimidin-3-ium-4-one Traditional Name: 2-(3-methyl-2-pyrindan-4-yl)-6-[(3S)-piperidin-1-ium-3-yl]-1H-pyrimidin-3-ium-4-one Formula: C18H24N4O+2 MolecularWeight: 312.40936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CCCC2=C1C3=[NH+]C(=O)C=C(N3)C4CCC[NH2+]C4

Isomeric SMILES

CC1=NC=C2CCCC2=C1C3=[NH+]C(=O)C=C(N3)[C@H]4CCC[NH2+]C4

InChI

InChI=1S/C18H22N4O/c1-11-17(14-6-2-4-12(14)10-20-11)18-21-15(8-16(23)22-18)13-5-3-7-19-9-13/h8,10,13,19H,2-7,9H2,1H3,(H,21,22,23)/p+2/t13-/m0/s1