3,3-diphenylpropyl-[2-(1H-indol-1-ium-2-yl)ethyl]azanium dichloride

Systemtic Name: 3,3-diphenylpropyl-[2-(1H-indol-1-ium-2-yl)ethyl]azanium dichloride Openeye Name: 3,3-diphenylpropyl-[2-(1H-indol-1-ium-2-yl)ethyl]ammonium dichloride CAS Name: 3,3-diphenylpropyl-[2-(1H-indol-1-ium-2-yl)ethyl]ammonium dichloride IUPAC Name: 3,3-diphenylpropyl-[2-(1H-indol-1-ium-2-yl)ethyl]azanium dichloride Traditional Name: 3,3-diphenylpropyl-[2-(1H-indol-1-ium-2-yl)ethyl]ammonium dichloride Formula: C25H28Cl2N2 MolecularWeight: 427.40922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC[NH2+]CCC2=CC3=CC=CC=C3[NH2+]2)C4=CC=CC=C4.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(CC[NH2+]CCC2=CC3=CC=CC=C3[NH2+]2)C4=CC=CC=C4.[Cl-].[Cl-]

InChI

InChI=1S/C25H26N2.2ClH/c1-3-9-20(10-4-1)24(21-11-5-2-6-12-21)16-18-26-17-15-23-19-22-13-7-8-14-25(22)27-23;;/h1-14,19,24,26-27H,15-18H2;2*1H