3-[(S)-(4-ethoxycarbonylpiperazin-1-yl)-pyridin-2-yl-methyl]-1-(2-methoxyethyl)-6-methyl-4-oxidanylidene-pyridin-2-olate

Systemtic Name: 3-[(S)-(4-ethoxycarbonylpiperazin-1-yl)-pyridin-2-yl-methyl]-1-(2-methoxyethyl)-6-methyl-4-oxidanylidene-pyridin-2-olate Openeye Name: 3-[(S)-(4-ethoxycarbonylpiperazin-1-yl)-(2-pyridyl)methyl]-1-(2-methoxyethyl)-6-methyl-4-oxo-pyridin-2-olate CAS Name: 3-[(S)-(4-ethoxycarbonyl-1-piperazinyl)-(2-pyridinyl)methyl]-1-(2-methoxyethyl)-6-methyl-4-oxo-2-pyridinolate IUPAC Name: 3-[(S)-(4-ethoxycarbonylpiperazin-1-yl)-pyridin-2-ylmethyl]-1-(2-methoxyethyl)-6-methyl-4-oxopyridin-2-olate Traditional Name: 3-[(S)-(4-carbethoxypiperazino)-(2-pyridyl)methyl]-4-keto-1-(2-methoxyethyl)-6-methyl-pyridin-2-olate Formula: C22H29N4O5- MolecularWeight: 429.48946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C2=CC=CC=N2)C3=C(N(C(=CC3=O)C)CCOC)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)[C@H](C2=CC=CC=N2)C3=C(N(C(=CC3=O)C)CCOC)[O-]

InChI

InChI=1S/C22H30N4O5/c1-4-31-22(29)25-11-9-24(10-12-25)20(17-7-5-6-8-23-17)19-18(27)15-16(2)26(21(19)28)13-14-30-3/h5-8,15,20,28H,4,9-14H2,1-3H3/p-1/t20-/m1/s1