methyl 4-[(E)-2-(5-methoxy-1,3,3-trimethyl-indol-1-ium-2-yl)ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-(5-methoxy-1,3,3-trimethyl-indol-1-ium-2-yl)ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-(5-methoxy-1,3,3-trimethyl-indol-1-ium-2-yl)vinyl]benzoate CAS Name: 4-[(E)-2-(5-methoxy-1,3,3-trimethyl-2-indol-1-iumyl)ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-(5-methoxy-1,3,3-trimethylindol-1-ium-2-yl)ethenyl]benzoate Traditional Name: 4-[(E)-2-(5-methoxy-1,3,3-trimethyl-indol-1-ium-2-yl)vinyl]benzoic acid methyl ester Formula: C22H24NO3+ MolecularWeight: 350.43086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24NO3/c1-22(2)18-14-17(25-4)11-12-19(18)23(3)20(22)13-8-15-6-9-16(10-7-15)21(24)26-5/h6-14H,1-5H3/q+1/b13-8+