(4E)-4-(1,2-dimethylindol-1-ium-3-ylidene)-2-[2-methyl-1-(phenylmethyl)indol-3-yl]-3-oxidanyl-cyclobut-2-en-1-one

Systemtic Name: (4E)-4-(1,2-dimethylindol-1-ium-3-ylidene)-2-[2-methyl-1-(phenylmethyl)indol-3-yl]-3-oxidanyl-cyclobut-2-en-1-one Openeye Name: (4E)-2-(1-benzyl-2-methyl-indol-3-yl)-4-(1,2-dimethylindol-1-ium-3-ylidene)-3-hydroxy-cyclobut-2-en-1-one CAS Name: (4E)-4-(1,2-dimethyl-3-indol-1-iumylidene)-3-hydroxy-2-[2-methyl-1-(phenylmethyl)-3-indolyl]-1-cyclobut-2-enone IUPAC Name: (4E)-2-(1-benzyl-2-methylindol-3-yl)-4-(1,2-dimethylindol-1-ium-3-ylidene)-3-hydroxycyclobut-2-en-1-one Traditional Name: (4E)-2-(1-benzyl-2-methyl-indol-3-yl)-4-(1,2-dimethylindol-1-ium-3-ylidene)-3-hydroxy-cyclobut-2-en-1-one Formula: C30H25N2O2+ MolecularWeight: 445.5317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)C4=C(C(=C5C(=[N+](C6=CC=CC=C65)C)C)C4=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)C4=C(/C(=C/5\C(=[N+](C6=CC=CC=C65)C)C)/C4=O)O

InChI

InChI=1S/C30H24N2O2/c1-18-25(21-13-7-9-15-23(21)31(18)3)27-29(33)28(30(27)34)26-19(2)32(17-20-11-5-4-6-12-20)24-16-10-8-14-22(24)26/h4-16H,17H2,1-3H3/p+1