3-[(2-chlorophenyl)-(1,1-diethylpyridin-1-ium-4-ylidene)methyl]-1-methyl-2-phenyl-indole

Systemtic Name: 3-[(2-chlorophenyl)-(1,1-diethylpyridin-1-ium-4-ylidene)methyl]-1-methyl-2-phenyl-indole Openeye Name: 3-[(2-chlorophenyl)-(1,1-diethylpyridin-1-ium-4-ylidene)methyl]-1-methyl-2-phenyl-indole CAS Name: 3-[(2-chlorophenyl)-(1,1-diethyl-4-pyridin-1-iumylidene)methyl]-1-methyl-2-phenylindole IUPAC Name: 3-[(2-chlorophenyl)-(1,1-diethylpyridin-1-ium-4-ylidene)methyl]-1-methyl-2-phenylindole Traditional Name: 3-[(2-chlorophenyl)-(1,1-diethylpyridin-1-ium-4-ylidene)methyl]-1-methyl-2-phenyl-indole Formula: C31H30ClN2+ MolecularWeight: 466.0363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=CC(=C(C2=CC=CC=C2Cl)C3=C(N(C4=CC=CC=C43)C)C5=CC=CC=C5)C=C1)CC

Isomeric SMILES

CC[N+]1(C=CC(=C(C2=CC=CC=C2Cl)C3=C(N(C4=CC=CC=C43)C)C5=CC=CC=C5)C=C1)CC

InChI

InChI=1S/C31H30ClN2/c1-4-34(5-2)21-19-23(20-22-34)29(25-15-9-11-17-27(25)32)30-26-16-10-12-18-28(26)33(3)31(30)24-13-7-6-8-14-24/h6-22H,4-5H2,1-3H3/q+1