(2S,3S)-7-oxidanyl-3-phenyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydrochromen-4-one

Systemtic Name: (2S,3S)-7-oxidanyl-3-phenyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydrochromen-4-one Openeye Name: (2S,3S)-7-hydroxy-3-phenyl-2-[4-[2-(1-piperidyl)ethoxy]phenyl]chroman-4-one CAS Name: (2S,3S)-7-hydroxy-3-phenyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (2S,3S)-7-hydroxy-3-phenyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydrochromen-4-one Traditional Name: (2S,3S)-7-hydroxy-3-phenyl-2-[4-(2-piperidinoethoxy)phenyl]chroman-4-one Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C3C(C(=O)C4=C(O3)C=C(C=C4)O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)[C@@H]3[C@@H](C(=O)C4=C(O3)C=C(C=C4)O)C5=CC=CC=C5

InChI

InChI=1S/C28H29NO4/c30-22-11-14-24-25(19-22)33-28(26(27(24)31)20-7-3-1-4-8-20)21-9-12-23(13-10-21)32-18-17-29-15-5-2-6-16-29/h1,3-4,7-14,19,26,28,30H,2,5-6,15-18H2/t26-,28-/m1/s1