6,8-bis[[(2S)-2-ethylpiperidin-1-yl]methyl]-5,7-bis(oxidanyl)-2-phenyl-chromen-4-one

Systemtic Name: 6,8-bis[[(2S)-2-ethylpiperidin-1-yl]methyl]-5,7-bis(oxidanyl)-2-phenyl-chromen-4-one Openeye Name: 6,8-bis[[(2S)-2-ethyl-1-piperidyl]methyl]-5,7-dihydroxy-2-phenyl-chromen-4-one CAS Name: 6,8-bis[[(2S)-2-ethyl-1-piperidinyl]methyl]-5,7-dihydroxy-2-phenyl-1-benzopyran-4-one IUPAC Name: 6,8-bis[[(2S)-2-ethylpiperidin-1-yl]methyl]-5,7-dihydroxy-2-phenylchromen-4-one Traditional Name: 6,8-bis[[(2S)-2-ethylpiperidino]methyl]-5,7-dihydroxy-2-phenyl-chromone Formula: C31H40N2O4 MolecularWeight: 504.6603

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CC2=C(C3=C(C(=C2O)CN4CCCCC4CC)OC(=CC3=O)C5=CC=CC=C5)O

Isomeric SMILES

CC[C@H]1CCCCN1CC2=C(C3=C(C(=C2O)CN4CCCC[C@@H]4CC)OC(=CC3=O)C5=CC=CC=C5)O

InChI

InChI=1S/C31H40N2O4/c1-3-22-14-8-10-16-32(22)19-24-29(35)25(20-33-17-11-9-15-23(33)4-2)31-28(30(24)36)26(34)18-27(37-31)21-12-6-5-7-13-21/h5-7,12-13,18,22-23,35-36H,3-4,8-11,14-17,19-20H2,1-2H3/t22-,23-/m0/s1