3,3-diphenylpropyl-[4-(2,4,5-trimethoxyphenyl)butan-2-yl]azanium chloride

Systemtic Name: 3,3-diphenylpropyl-[4-(2,4,5-trimethoxyphenyl)butan-2-yl]azanium chloride Openeye Name: 3,3-diphenylpropyl-[1-methyl-3-(2,4,5-trimethoxyphenyl)propyl]ammonium chloride CAS Name: 3,3-diphenylpropyl-[4-(2,4,5-trimethoxyphenyl)butan-2-yl]ammonium chloride IUPAC Name: 3,3-diphenylpropyl-[4-(2,4,5-trimethoxyphenyl)butan-2-yl]azanium chloride Traditional Name: (3-asaryl-1-methyl-propyl)-(3,3-diphenylpropyl)ammonium chloride Formula: C28H36ClNO3 MolecularWeight: 470.04334

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC(=C(C=C1OC)OC)OC)[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC(CCC1=CC(=C(C=C1OC)OC)OC)[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C28H35NO3.ClH/c1-21(15-16-24-19-27(31-3)28(32-4)20-26(24)30-2)29-18-17-25(22-11-7-5-8-12-22)23-13-9-6-10-14-23;/h5-14,19-21,25,29H,15-18H2,1-4H3;1H