2-methoxy-4-[5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2-methoxy-4-[5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2-methoxy-4-[5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 2-methoxy-4-[5-[(3S)-3-piperidin-1-iumyl]-1,2,4-oxadiazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2-methoxy-4-[5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2-methoxy-4-[5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C14H18N3O3+ MolecularWeight: 276.31102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2NOC(=N2)C3CCC[NH2+]C3)C=CC1=O

Isomeric SMILES

COC1=CC(=C2NOC(=N2)[C@H]3CCC[NH2+]C3)C=CC1=O

InChI

InChI=1S/C14H17N3O3/c1-19-12-7-9(4-5-11(12)18)13-16-14(20-17-13)10-3-2-6-15-8-10/h4-5,7,10,15,17H,2-3,6,8H2,1H3/p+1/t10-/m0/s1