methyl (2E)-2-[(5-methoxycarbonyl-1,3,3-trimethyl-indol-1-ium-2-yl)methylidene]-1,3,3-trimethyl-indole-5-carboxylate

Systemtic Name: methyl (2E)-2-[(5-methoxycarbonyl-1,3,3-trimethyl-indol-1-ium-2-yl)methylidene]-1,3,3-trimethyl-indole-5-carboxylate Openeye Name: methyl (2E)-2-[(5-methoxycarbonyl-1,3,3-trimethyl-indol-1-ium-2-yl)methylene]-1,3,3-trimethyl-indoline-5-carboxylate CAS Name: (2E)-2-[(5-methoxycarbonyl-1,3,3-trimethyl-2-indol-1-iumyl)methylidene]-1,3,3-trimethyl-5-indolecarboxylic acid methyl ester IUPAC Name: methyl (2E)-2-[(5-methoxycarbonyl-1,3,3-trimethylindol-1-ium-2-yl)methylidene]-1,3,3-trimethylindole-5-carboxylate Traditional Name: (2E)-2-[(5-carbomethoxy-1,3,3-trimethyl-indol-1-ium-2-yl)methylene]-1,3,3-trimethyl-indoline-5-carboxylic acid methyl ester Formula: C27H31N2O4+ MolecularWeight: 447.54604

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C(=O)OC)N(C1=CC3=[N+](C4=C(C3(C)C)C=C(C=C4)C(=O)OC)C)C)C

Isomeric SMILES

CC\1(C2=C(C=CC(=C2)C(=O)OC)N(/C1=C/C3=[N+](C4=C(C3(C)C)C=C(C=C4)C(=O)OC)C)C)C

InChI

InChI=1S/C27H31N2O4/c1-26(2)18-13-16(24(30)32-7)9-11-20(18)28(5)22(26)15-23-27(3,4)19-14-17(25(31)33-8)10-12-21(19)29(23)6/h9-15H,1-8H3/q+1