4-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]-7,8-dimethyl-chromen-2-one

Systemtic Name: 4-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]-7,8-dimethyl-chromen-2-one Openeye Name: 4-[[(3R)-3-(hydroxymethyl)-1-piperidyl]methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[[(3R)-3-(hydroxymethyl)-1-piperidinyl]methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]-7,8-dimethylchromen-2-one Traditional Name: 7,8-dimethyl-4-[[(3R)-3-methylolpiperidino]methyl]coumarin Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3CCCC(C3)CO)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3CCC[C@H](C3)CO)C

InChI

InChI=1S/C18H23NO3/c1-12-5-6-16-15(8-17(21)22-18(16)13(12)2)10-19-7-3-4-14(9-19)11-20/h5-6,8,14,20H,3-4,7,9-11H2,1-2H3/t14-/m1/s1