6-[(3R)-3-oxidanylpiperidin-1-yl]-[1,3]dioxolo[4,5-g]quinolin-5-ium-7-carbonitrile

Systemtic Name: 6-[(3R)-3-oxidanylpiperidin-1-yl]-[1,3]dioxolo[4,5-g]quinolin-5-ium-7-carbonitrile Openeye Name: 6-[(3R)-3-hydroxy-1-piperidyl]-[1,3]dioxolo[4,5-g]quinolin-5-ium-7-carbonitrile CAS Name: 6-[(3R)-3-hydroxy-1-piperidinyl]-[1,3]dioxolo[4,5-g]quinolin-5-ium-7-carbonitrile IUPAC Name: 6-[(3R)-3-hydroxypiperidin-1-yl]-[1,3]dioxolo[4,5-g]quinolin-5-ium-7-carbonitrile Traditional Name: 6-[(3R)-3-hydroxypiperidino]-[1,3]dioxolo[4,5-g]quinolin-5-ium-7-carbonitrile Formula: C16H16N3O3+ MolecularWeight: 298.31654

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=[NH+]C3=CC4=C(C=C3C=C2C#N)OCO4)O

Isomeric SMILES

C1C[C@H](CN(C1)C2=[NH+]C3=CC4=C(C=C3C=C2C#N)OCO4)O

InChI

InChI=1S/C16H15N3O3/c17-7-11-4-10-5-14-15(22-9-21-14)6-13(10)18-16(11)19-3-1-2-12(20)8-19/h4-6,12,20H,1-3,8-9H2/p+1/t12-/m1/s1