3-[[(3R,4R)-4-[methyl(2-pyridin-2-ylethyl)amino]-3-oxidanyl-piperidin-1-yl]methyl]chromen-4-one

Systemtic Name: 3-[[(3R,4R)-4-[methyl(2-pyridin-2-ylethyl)amino]-3-oxidanyl-piperidin-1-yl]methyl]chromen-4-one Openeye Name: 3-[[(3R,4R)-3-hydroxy-4-[methyl-[2-(2-pyridyl)ethyl]amino]-1-piperidyl]methyl]chromen-4-one CAS Name: 3-[[(3R,4R)-3-hydroxy-4-[methyl-[2-(2-pyridinyl)ethyl]amino]-1-piperidinyl]methyl]-1-benzopyran-4-one IUPAC Name: 3-[[(3R,4R)-3-hydroxy-4-[methyl(2-pyridin-2-ylethyl)amino]piperidin-1-yl]methyl]chromen-4-one Traditional Name: 3-[[(3R,4R)-3-hydroxy-4-[methyl-[2-(2-pyridyl)ethyl]amino]piperidino]methyl]chromone Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2CCN(CC2O)CC3=COC4=CC=CC=C4C3=O

Isomeric SMILES

CN(CCC1=CC=CC=N1)[C@@H]2CCN(C[C@H]2O)CC3=COC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H27N3O3/c1-25(12-9-18-6-4-5-11-24-18)20-10-13-26(15-21(20)27)14-17-16-29-22-8-3-2-7-19(22)23(17)28/h2-8,11,16,20-21,27H,9-10,12-15H2,1H3/t20-,21-/m1/s1