1-[[4-(4-methoxyphenyl)-2-oxidanylidene-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]carbonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[4-(4-methoxyphenyl)-2-oxidanylidene-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]carbonyl]piperidine-4-carboxylic acid Openeye Name: 1-[4-(4-methoxyphenyl)-2-oxo-3-[1-(4-pyridyl)-4-piperidyl]oxazolidine-5-carbonyl]piperidine-4-carboxylic acid CAS Name: 1-[[4-(4-methoxyphenyl)-2-oxo-3-(1-pyridin-4-yl-4-piperidinyl)-5-oxazolidinyl]-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[4-(4-methoxyphenyl)-2-oxo-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidine-5-carbonyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-keto-4-(4-methoxyphenyl)-3-[1-(4-pyridyl)-4-piperidyl]oxazolidine-5-carbonyl]isonipecotic acid Formula: C27H32N4O6 MolecularWeight: 508.56618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(OC(=O)N2C3CCN(CC3)C4=CC=NC=C4)C(=O)N5CCC(CC5)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2C(OC(=O)N2C3CCN(CC3)C4=CC=NC=C4)C(=O)N5CCC(CC5)C(=O)O

InChI

InChI=1S/C27H32N4O6/c1-36-22-4-2-18(3-5-22)23-24(25(32)30-14-8-19(9-15-30)26(33)34)37-27(35)31(23)21-10-16-29(17-11-21)20-6-12-28-13-7-20/h2-7,12-13,19,21,23-24H,8-11,14-17H2,1H3,(H,33,34)