2-(4-chlorophenyl)-1,3-dimethyl-5-phenylmethoxy-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indol-1-ium

Systemtic Name: 2-(4-chlorophenyl)-1,3-dimethyl-5-phenylmethoxy-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indol-1-ium Openeye Name: 5-benzyloxy-2-(4-chlorophenyl)-1,3-dimethyl-1-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]indol-1-ium CAS Name: 2-(4-chlorophenyl)-1,3-dimethyl-5-phenylmethoxy-1-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]indol-1-ium IUPAC Name: 2-(4-chlorophenyl)-1,3-dimethyl-5-phenylmethoxy-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indol-1-ium Traditional Name: 5-benzoxy-2-(4-chlorophenyl)-1,3-dimethyl-1-[4-(2-piperidinoethoxy)benzyl]indol-1-ium Formula: C37H40ClN2O2+ MolecularWeight: 580.1787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](C2=C1C=C(C=C2)OCC3=CC=CC=C3)(C)CC4=CC=C(C=C4)OCCN5CCCCC5)C6=CC=C(C=C6)Cl

Isomeric SMILES

CC1=C([N+](C2=C1C=C(C=C2)OCC3=CC=CC=C3)(C)CC4=CC=C(C=C4)OCCN5CCCCC5)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C37H40ClN2O2/c1-28-35-25-34(42-27-30-9-5-3-6-10-30)19-20-36(35)40(2,37(28)31-13-15-32(38)16-14-31)26-29-11-17-33(18-12-29)41-24-23-39-21-7-4-8-22-39/h3,5-6,9-20,25H,4,7-8,21-24,26-27H2,1-2H3/q+1