4-ethyl-7-oxidanyl-8-[[[1-(phenylmethyl)piperidin-4-yl]amino]methyl]chromen-2-one dihydrochloride

Systemtic Name: 4-ethyl-7-oxidanyl-8-[[[1-(phenylmethyl)piperidin-4-yl]amino]methyl]chromen-2-one dihydrochloride Openeye Name: 8-[[(1-benzyl-4-piperidyl)amino]methyl]-4-ethyl-7-hydroxy-chromen-2-one dihydrochloride CAS Name: 4-ethyl-7-hydroxy-8-[[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]-1-benzopyran-2-one dihydrochloride IUPAC Name: 8-[[(1-benzylpiperidin-4-yl)amino]methyl]-4-ethyl-7-hydroxychromen-2-one dihydrochloride Traditional Name: 8-[[(1-benzyl-4-piperidyl)amino]methyl]-4-ethyl-7-hydroxy-coumarin dihydrochloride Formula: C24H30Cl2N2O3 MolecularWeight: 465.4126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2CNC3CCN(CC3)CC4=CC=CC=C4)O.Cl.Cl

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2CNC3CCN(CC3)CC4=CC=CC=C4)O.Cl.Cl

InChI

InChI=1S/C24H28N2O3.2ClH/c1-2-18-14-23(28)29-24-20(18)8-9-22(27)21(24)15-25-19-10-12-26(13-11-19)16-17-6-4-3-5-7-17;;/h3-9,14,19,25,27H,2,10-13,15-16H2,1H3;2*1H