2-[5-chloranyl-1-[2,6-di(propan-2-yl)phenyl]-1-methyl-3-phenyl-indol-1-ium-2-yl]ethanamide

Systemtic Name: 2-[5-chloranyl-1-[2,6-di(propan-2-yl)phenyl]-1-methyl-3-phenyl-indol-1-ium-2-yl]ethanamide Openeye Name: 2-[5-chloro-1-(2,6-diisopropylphenyl)-1-methyl-3-phenyl-indol-1-ium-2-yl]acetamide CAS Name: 2-[5-chloro-1-[2,6-di(propan-2-yl)phenyl]-1-methyl-3-phenyl-2-indol-1-iumyl]acetamide IUPAC Name: 2-[5-chloro-1-[2,6-di(propan-2-yl)phenyl]-1-methyl-3-phenylindol-1-ium-2-yl]acetamide Traditional Name: 2-[5-chloro-1-(2,6-diisopropylphenyl)-1-methyl-3-phenyl-indol-1-ium-2-yl]acetamide Formula: C29H32ClN2O+ MolecularWeight: 460.03018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)[N+]2(C3=C(C=C(C=C3)Cl)C(=C2CC(=O)N)C4=CC=CC=C4)C

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)[N+]2(C3=C(C=C(C=C3)Cl)C(=C2CC(=O)N)C4=CC=CC=C4)C

InChI

InChI=1S/C29H31ClN2O/c1-18(2)22-12-9-13-23(19(3)4)29(22)32(5)25-15-14-21(30)16-24(25)28(26(32)17-27(31)33)20-10-7-6-8-11-20/h6-16,18-19H,17H2,1-5H3,(H-,31,33)/p+1