3-[(3S)-1-propylpiperidin-1-ium-3-yl]pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(3S)-1-propylpiperidin-1-ium-3-yl]pyrido[2,3-d]pyrimidin-4-one Openeye Name: 3-[(3S)-1-propylpiperidin-1-ium-3-yl]pyrido[2,3-d]pyrimidin-4-one CAS Name: 3-[(3S)-1-propyl-3-piperidin-1-iumyl]-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 3-[(3S)-1-propylpiperidin-1-ium-3-yl]pyrido[2,3-d]pyrimidin-4-one Traditional Name: 3-[(3S)-1-propylpiperidin-1-ium-3-yl]pyrido[2,3-d]pyrimidin-4-one Formula: C15H21N4O+ MolecularWeight: 273.35344

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCCC(C1)N2C=NC3=C(C2=O)C=CC=N3

Isomeric SMILES

CCC[NH+]1CCC[C@@H](C1)N2C=NC3=C(C2=O)C=CC=N3

InChI

InChI=1S/C15H20N4O/c1-2-8-18-9-4-5-12(10-18)19-11-17-14-13(15(19)20)6-3-7-16-14/h3,6-7,11-12H,2,4-5,8-10H2,1H3/p+1/t12-/m0/s1