1-(phenylmethyl)-3-[1-[1-(phenylmethyl)indol-1-ium-3-ylidene]ethyl]indole

Systemtic Name: 1-(phenylmethyl)-3-[1-[1-(phenylmethyl)indol-1-ium-3-ylidene]ethyl]indole Openeye Name: 1-benzyl-3-[1-(1-benzylindol-1-ium-3-ylidene)ethyl]indole CAS Name: 1-(phenylmethyl)-3-[1-[1-(phenylmethyl)-3-indol-1-iumylidene]ethyl]indole IUPAC Name: 1-benzyl-3-[1-(1-benzylindol-1-ium-3-ylidene)ethyl]indole Traditional Name: 1-benzyl-3-[1-(1-benzylindol-1-ium-3-ylidene)ethyl]indole Formula: C32H27N2+ MolecularWeight: 439.57018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

CC(=C1C=[N+](C2=CC=CC=C21)CC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C32H27N2/c1-24(29-22-33(20-25-12-4-2-5-13-25)31-18-10-8-16-27(29)31)30-23-34(21-26-14-6-3-7-15-26)32-19-11-9-17-28(30)32/h2-19,22-23H,20-21H2,1H3/q+1