methyl 1-ethyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-3,3-dimethyl-indol-1-ium-6-carboxylate

Systemtic Name: methyl 1-ethyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-3,3-dimethyl-indol-1-ium-6-carboxylate Openeye Name: methyl 1-ethyl-2-[(E)-2-(4-methoxyphenyl)vinyl]-3,3-dimethyl-indol-1-ium-6-carboxylate CAS Name: 1-ethyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-3,3-dimethyl-6-indol-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-3,3-dimethylindol-1-ium-6-carboxylate Traditional Name: 1-ethyl-2-[(E)-2-(4-methoxyphenyl)vinyl]-3,3-dimethyl-indol-1-ium-6-carboxylic acid methyl ester Formula: C23H26NO3+ MolecularWeight: 364.45744

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C(C2=C1C=C(C=C2)C(=O)OC)(C)C)C=CC3=CC=C(C=C3)OC

Isomeric SMILES

CC[N+]1=C(C(C2=C1C=C(C=C2)C(=O)OC)(C)C)/C=C/C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H26NO3/c1-6-24-20-15-17(22(25)27-5)10-13-19(20)23(2,3)21(24)14-9-16-7-11-18(26-4)12-8-16/h7-15H,6H2,1-5H3/q+1/b14-9+