4-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]-7-methyl-6-propan-2-yl-chromen-2-one

Systemtic Name: 4-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]-7-methyl-6-propan-2-yl-chromen-2-one Openeye Name: 4-[[(3R)-3-(hydroxymethyl)-1-piperidyl]methyl]-6-isopropyl-7-methyl-chromen-2-one CAS Name: 4-[[(3R)-3-(hydroxymethyl)-1-piperidinyl]methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 6-isopropyl-7-methyl-4-[[(3R)-3-methylolpiperidino]methyl]coumarin Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCCC(C3)CO)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCC[C@H](C3)CO)C(C)C

InChI

InChI=1S/C20H27NO3/c1-13(2)17-9-18-16(8-20(23)24-19(18)7-14(17)3)11-21-6-4-5-15(10-21)12-22/h7-9,13,15,22H,4-6,10-12H2,1-3H3/t15-/m1/s1