6,8-bis[[(3S)-3-methylpiperidin-1-yl]methyl]-5,7-bis(oxidanyl)-2-phenyl-chromen-4-one

Systemtic Name: 6,8-bis[[(3S)-3-methylpiperidin-1-yl]methyl]-5,7-bis(oxidanyl)-2-phenyl-chromen-4-one Openeye Name: 5,7-dihydroxy-6,8-bis[[(3S)-3-methyl-1-piperidyl]methyl]-2-phenyl-chromen-4-one CAS Name: 5,7-dihydroxy-6,8-bis[[(3S)-3-methyl-1-piperidinyl]methyl]-2-phenyl-1-benzopyran-4-one IUPAC Name: 5,7-dihydroxy-6,8-bis[[(3S)-3-methylpiperidin-1-yl]methyl]-2-phenylchromen-4-one Traditional Name: 5,7-dihydroxy-6,8-bis[[(3S)-3-methylpiperidino]methyl]-2-phenyl-chromone Formula: C29H36N2O4 MolecularWeight: 476.60714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=C(C3=C(C(=C2O)CN4CCCC(C4)C)OC(=CC3=O)C5=CC=CC=C5)O

Isomeric SMILES

C[C@H]1CCCN(C1)CC2=C(C3=C(C(=C2O)CN4CCC[C@@H](C4)C)OC(=CC3=O)C5=CC=CC=C5)O

InChI

InChI=1S/C29H36N2O4/c1-19-8-6-12-30(15-19)17-22-27(33)23(18-31-13-7-9-20(2)16-31)29-26(28(22)34)24(32)14-25(35-29)21-10-4-3-5-11-21/h3-5,10-11,14,19-20,33-34H,6-9,12-13,15-18H2,1-2H3/t19-,20-/m0/s1