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

Systemtic Name: 1-[(3S)-6-ethanoyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]piperidin-2-one Openeye Name: 1-[(3S)-6-acetyl-3-hydroxy-2,2-dimethyl-chroman-4-yl]piperidin-2-one CAS Name: 1-[(3S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-piperidinone IUPAC Name: 1-[(3S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]piperidin-2-one Traditional Name: 1-[(3S)-6-acetyl-3-hydroxy-2,2-dimethyl-chroman-4-yl]-2-piperidone Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(C2N3CCCCC3=O)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC([C@H](C2N3CCCCC3=O)O)(C)C

InChI

InChI=1S/C18H23NO4/c1-11(20)12-7-8-14-13(10-12)16(17(22)18(2,3)23-14)19-9-5-4-6-15(19)21/h7-8,10,16-17,22H,4-6,9H2,1-3H3/t16?,17-/m0/s1