[(3R)-1-[(3-methylquinoxalin-2-yl)methyl]-3-(3-phenylpropyl)piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3R)-1-[(3-methylquinoxalin-2-yl)methyl]-3-(3-phenylpropyl)piperidin-1-ium-3-yl]methanol Openeye Name: [(3R)-1-[(3-methylquinoxalin-2-yl)methyl]-3-(3-phenylpropyl)piperidin-1-ium-3-yl]methanol CAS Name: [(3R)-1-[(3-methyl-2-quinoxalinyl)methyl]-3-(3-phenylpropyl)-3-piperidin-1-iumyl]methanol IUPAC Name: [(3R)-1-[(3-methylquinoxalin-2-yl)methyl]-3-(3-phenylpropyl)piperidin-1-ium-3-yl]methanol Traditional Name: [(3R)-1-[(3-methylquinoxalin-2-yl)methyl]-3-(3-phenylpropyl)piperidin-1-ium-3-yl]methanol Formula: C25H32N3O+ MolecularWeight: 390.54108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1C[NH+]3CCCC(C3)(CCCC4=CC=CC=C4)CO

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1C[NH+]3CCC[C@@](C3)(CCCC4=CC=CC=C4)CO

InChI

InChI=1S/C25H31N3O/c1-20-24(27-23-13-6-5-12-22(23)26-20)17-28-16-8-15-25(18-28,19-29)14-7-11-21-9-3-2-4-10-21/h2-6,9-10,12-13,29H,7-8,11,14-19H2,1H3/p+1/t25-/m1/s1