(2R)-1-(5-methyl-2,3-diphenyl-indol-1-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(5-methyl-2,3-diphenyl-indol-1-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-(5-methyl-2,3-diphenyl-indol-1-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2R)-1-(5-methyl-2,3-diphenyl-1-indolyl)-3-(4-phenethyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2R)-1-(5-methyl-2,3-diphenylindol-1-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-(5-methyl-2,3-diphenyl-indol-1-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C36H40N3O+ MolecularWeight: 530.7223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)CC(CN5CC[NH+](CC5)CCC6=CC=CC=C6)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C[C@@H](CN5CC[NH+](CC5)CCC6=CC=CC=C6)O

InChI

InChI=1S/C36H39N3O/c1-28-17-18-34-33(25-28)35(30-13-7-3-8-14-30)36(31-15-9-4-10-16-31)39(34)27-32(40)26-38-23-21-37(22-24-38)20-19-29-11-5-2-6-12-29/h2-18,25,32,40H,19-24,26-27H2,1H3/p+1/t32-/m1/s1