3-[(R)-(4-ethoxycarbonylpiperidin-1-ium-1-yl)-pyridin-3-yl-methyl]-1-(2-methoxyethyl)-6-methyl-4-oxidanylidene-pyridin-2-olate

Systemtic Name: 3-[(R)-(4-ethoxycarbonylpiperidin-1-ium-1-yl)-pyridin-3-yl-methyl]-1-(2-methoxyethyl)-6-methyl-4-oxidanylidene-pyridin-2-olate Openeye Name: 3-[(R)-(4-ethoxycarbonylpiperidin-1-ium-1-yl)-(3-pyridyl)methyl]-1-(2-methoxyethyl)-6-methyl-4-oxo-pyridin-2-olate CAS Name: 3-[(R)-(4-ethoxycarbonyl-1-piperidin-1-iumyl)-(3-pyridinyl)methyl]-1-(2-methoxyethyl)-6-methyl-4-oxo-2-pyridinolate IUPAC Name: 3-[(R)-(4-ethoxycarbonylpiperidin-1-ium-1-yl)-pyridin-3-ylmethyl]-1-(2-methoxyethyl)-6-methyl-4-oxopyridin-2-olate Traditional Name: 3-[(R)-(4-carbethoxypiperidin-1-ium-1-yl)-(3-pyridyl)methyl]-4-keto-1-(2-methoxyethyl)-6-methyl-pyridin-2-olate Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)C(C2=CN=CC=C2)C3=C(N(C(=CC3=O)C)CCOC)[O-]

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)[C@H](C2=CN=CC=C2)C3=C(N(C(=CC3=O)C)CCOC)[O-]

InChI

InChI=1S/C23H31N3O5/c1-4-31-23(29)17-7-10-25(11-8-17)21(18-6-5-9-24-15-18)20-19(27)14-16(2)26(22(20)28)12-13-30-3/h5-6,9,14-15,17,21,28H,4,7-8,10-13H2,1-3H3/t21-/m1/s1