3-(4-hydroxyphenyl)-3-methyl-4-[4-[5-(1-oxidanylpiperidin-1-ium-1-yl)pentoxy]phenyl]-2,4-dihydrochromen-7-ol

Systemtic Name: 3-(4-hydroxyphenyl)-3-methyl-4-[4-[5-(1-oxidanylpiperidin-1-ium-1-yl)pentoxy]phenyl]-2,4-dihydrochromen-7-ol Openeye Name: 3-(4-hydroxyphenyl)-4-[4-[5-(1-hydroxypiperidin-1-ium-1-yl)pentoxy]phenyl]-3-methyl-chroman-7-ol CAS Name: 3-(4-hydroxyphenyl)-4-[4-[5-(1-hydroxy-1-piperidin-1-iumyl)pentoxy]phenyl]-3-methyl-3,4-dihydro-2H-1-benzopyran-7-ol IUPAC Name: 3-(4-hydroxyphenyl)-4-[4-[5-(1-hydroxypiperidin-1-ium-1-yl)pentoxy]phenyl]-3-methyl-2,4-dihydrochromen-7-ol Traditional Name: 3-(4-hydroxyphenyl)-4-[4-[5-(1-hydroxypiperidin-1-ium-1-yl)pentoxy]phenyl]-3-methyl-chroman-7-ol Formula: C32H40NO5+ MolecularWeight: 518.6637

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C1C3=CC=C(C=C3)OCCCCC[N+]4(CCCCC4)O)C=CC(=C2)O)C5=CC=C(C=C5)O

Isomeric SMILES

CC1(COC2=C(C1C3=CC=C(C=C3)OCCCCC[N+]4(CCCCC4)O)C=CC(=C2)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C32H39NO5/c1-32(25-10-12-26(34)13-11-25)23-38-30-22-27(35)14-17-29(30)31(32)24-8-15-28(16-9-24)37-21-7-3-6-20-33(36)18-4-2-5-19-33/h8-17,22,31,36H,2-7,18-21,23H2,1H3,(H-,34,35)/p+1