2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1,3,3-trimethyl-indol-1-ium-5-carboxylic acid

Systemtic Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1,3,3-trimethyl-indol-1-ium-5-carboxylic acid Openeye Name: 2-[(E)-2-(4-dimethylaminophenyl)vinyl]-1,3,3-trimethyl-indol-1-ium-5-carboxylic acid CAS Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1,3,3-trimethyl-5-indol-1-iumcarboxylic acid IUPAC Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1,3,3-trimethylindol-1-ium-5-carboxylic acid Traditional Name: 2-[(E)-2-(4-dimethylaminophenyl)vinyl]-1,3,3-trimethyl-indol-1-ium-5-carboxylic acid Formula: C22H25N2O2+ MolecularWeight: 349.4461

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C(=O)O)[N+](=C1C=CC3=CC=C(C=C3)N(C)C)C)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C(=O)O)[N+](=C1/C=C/C3=CC=C(C=C3)N(C)C)C)C

InChI

InChI=1S/C22H24N2O2/c1-22(2)18-14-16(21(25)26)9-12-19(18)24(5)20(22)13-8-15-6-10-17(11-7-15)23(3)4/h6-14H,1-5H3/p+1