1-[(3S,4R)-2,2-dimethyl-6-(2-methylpyridin-4-yl)-3-oxidanyl-3,4-dihydrochromen-4-yl]piperidin-2-one

Systemtic Name: 1-[(3S,4R)-2,2-dimethyl-6-(2-methylpyridin-4-yl)-3-oxidanyl-3,4-dihydrochromen-4-yl]piperidin-2-one Openeye Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-(2-methyl-4-pyridyl)chroman-4-yl]piperidin-2-one CAS Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-(2-methyl-4-pyridinyl)-3,4-dihydro-2H-1-benzopyran-4-yl]-2-piperidinone IUPAC Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-(2-methylpyridin-4-yl)-3,4-dihydrochromen-4-yl]piperidin-2-one Traditional Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-(2-methyl-4-pyridyl)chroman-4-yl]-2-piperidone Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=CC3=C(C=C2)OC(C(C3N4CCCCC4=O)O)(C)C

Isomeric SMILES

CC1=NC=CC(=C1)C2=CC3=C(C=C2)OC([C@H]([C@@H]3N4CCCCC4=O)O)(C)C

InChI

InChI=1S/C22H26N2O3/c1-14-12-16(9-10-23-14)15-7-8-18-17(13-15)20(21(26)22(2,3)27-18)24-11-5-4-6-19(24)25/h7-10,12-13,20-21,26H,4-6,11H2,1-3H3/t20-,21+/m1/s1