[3-(5-methyl-2,3-diphenyl-indol-1-yl)-2-oxidanyl-propyl]-(2-methylphenyl)azanium chloride

Systemtic Name: [3-(5-methyl-2,3-diphenyl-indol-1-yl)-2-oxidanyl-propyl]-(2-methylphenyl)azanium chloride Openeye Name: [2-hydroxy-3-(5-methyl-2,3-diphenyl-indol-1-yl)propyl]-(o-tolyl)ammonium chloride CAS Name: [2-hydroxy-3-(5-methyl-2,3-diphenyl-1-indolyl)propyl]-(2-methylphenyl)ammonium chloride IUPAC Name: [2-hydroxy-3-(5-methyl-2,3-diphenylindol-1-yl)propyl]-(2-methylphenyl)azanium chloride Traditional Name: [2-hydroxy-3-(5-methyl-2,3-diphenyl-indol-1-yl)propyl]-(o-tolyl)ammonium chloride Formula: C31H31ClN2O MolecularWeight: 483.04364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)CC(C[NH2+]C5=CC=CC=C5C)O.[Cl-]

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)CC(C[NH2+]C5=CC=CC=C5C)O.[Cl-]

InChI

InChI=1S/C31H30N2O.ClH/c1-22-17-18-29-27(19-22)30(24-12-5-3-6-13-24)31(25-14-7-4-8-15-25)33(29)21-26(34)20-32-28-16-10-9-11-23(28)2;/h3-19,26,32,34H,20-21H2,1-2H3;1H