9-(2-ethyl-3,4-dimethyl-pyrrol-3-yl)-6,9-dimethoxy-carbazol-9-ium-2-carboxylic acid

Systemtic Name: 9-(2-ethyl-3,4-dimethyl-pyrrol-3-yl)-6,9-dimethoxy-carbazol-9-ium-2-carboxylic acid Openeye Name: 9-(2-ethyl-3,4-dimethyl-pyrrol-3-yl)-6,9-dimethoxy-carbazol-9-ium-2-carboxylic acid CAS Name: 9-(2-ethyl-3,4-dimethyl-3-pyrrolyl)-6,9-dimethoxy-2-carbazol-9-iumcarboxylic acid IUPAC Name: 9-(2-ethyl-3,4-dimethylpyrrol-3-yl)-6,9-dimethoxycarbazol-9-ium-2-carboxylic acid Traditional Name: 9-(2-ethyl-3,4-dimethyl-pyrrol-3-yl)-6,9-dimethoxy-carbazol-9-ium-2-carboxylic acid Formula: C23H25N2O4+ MolecularWeight: 393.4556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C1(C)[N+]2(C3=C(C=C(C=C3)OC)C4=C2C=C(C=C4)C(=O)O)OC)C

Isomeric SMILES

CCC1=NC=C(C1(C)[N+]2(C3=C(C=C(C=C3)OC)C4=C2C=C(C=C4)C(=O)O)OC)C

InChI

InChI=1S/C23H24N2O4/c1-6-21-23(3,14(2)13-24-21)25(29-5)19-10-8-16(28-4)12-18(19)17-9-7-15(22(26)27)11-20(17)25/h7-13H,6H2,1-5H3/p+1