1-(3-hydroxyphenyl)-1-[4-(2-piperidin-1-ylethoxy)phenyl]-3,4-dihydro-2H-quinolin-1-ium-6-ol

Systemtic Name: 1-(3-hydroxyphenyl)-1-[4-(2-piperidin-1-ylethoxy)phenyl]-3,4-dihydro-2H-quinolin-1-ium-6-ol Openeye Name: 1-(3-hydroxyphenyl)-1-[4-[2-(1-piperidyl)ethoxy]phenyl]-3,4-dihydro-2H-quinolin-1-ium-6-ol CAS Name: 1-(3-hydroxyphenyl)-1-[4-[2-(1-piperidinyl)ethoxy]phenyl]-3,4-dihydro-2H-quinolin-1-ium-6-ol IUPAC Name: 1-(3-hydroxyphenyl)-1-[4-(2-piperidin-1-ylethoxy)phenyl]-3,4-dihydro-2H-quinolin-1-ium-6-ol Traditional Name: 1-(3-hydroxyphenyl)-1-[4-(2-piperidinoethoxy)phenyl]-3,4-dihydro-2H-quinolin-1-ium-6-ol Formula: C28H33N2O3+ MolecularWeight: 445.57322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)[N+]3(CCCC4=C3C=CC(=C4)O)C5=CC(=CC=C5)O

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)[N+]3(CCCC4=C3C=CC(=C4)O)C5=CC(=CC=C5)O

InChI

InChI=1S/C28H32N2O3/c31-25-8-4-7-24(21-25)30(18-5-6-22-20-26(32)11-14-28(22)30)23-9-12-27(13-10-23)33-19-17-29-15-2-1-3-16-29/h4,7-14,20-21H,1-3,5-6,15-19H2,(H-,31,32)/p+1