6-chloranyl-4-methyl-8-[[(3R)-3-methylpiperidin-1-yl]methyl]-7-oxidanyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-8-[[(3R)-3-methylpiperidin-1-yl]methyl]-7-oxidanyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-[[(3R)-3-methyl-1-piperidyl]methyl]chromen-2-one CAS Name: 6-chloro-7-hydroxy-4-methyl-8-[[(3R)-3-methyl-1-piperidinyl]methyl]-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-[[(3R)-3-methylpiperidin-1-yl]methyl]chromen-2-one Traditional Name: 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-[[(3R)-3-methylpiperidino]methyl]coumarin Formula: C24H26ClNO3 MolecularWeight: 411.92114

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=C3C(=CC(=C2O)Cl)C(=C(C(=O)O3)CC4=CC=CC=C4)C

Isomeric SMILES

C[C@@H]1CCCN(C1)CC2=C3C(=CC(=C2O)Cl)C(=C(C(=O)O3)CC4=CC=CC=C4)C

InChI

InChI=1S/C24H26ClNO3/c1-15-7-6-10-26(13-15)14-20-22(27)21(25)12-18-16(2)19(24(28)29-23(18)20)11-17-8-4-3-5-9-17/h3-5,8-9,12,15,27H,6-7,10-11,13-14H2,1-2H3/t15-/m1/s1