4-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-indol-1-yl]carbonyloxybenzoic acid

Systemtic Name: 4-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-indol-1-yl]carbonyloxybenzoic acid Openeye Name: 4-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylene]-2-oxo-indoline-1-carbonyl]oxybenzoic acid CAS Name: 4-[[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxo-1-indolyl]-oxomethoxy]benzoic acid IUPAC Name: 4-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxoindole-1-carbonyl]oxybenzoic acid Traditional Name: 4-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylene]-2-keto-indoline-1-carbonyl]oxybenzoic acid Formula: C23H18N2O5 MolecularWeight: 402.39942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C=C2C3=CC=CC=C3N(C2=O)C(=O)OC4=CC=C(C=C4)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(N1)/C=C/2\C3=CC=CC=C3N(C2=O)C(=O)OC4=CC=C(C=C4)C(=O)O)C

InChI

InChI=1S/C23H18N2O5/c1-13-11-14(2)24-19(13)12-18-17-5-3-4-6-20(17)25(21(18)26)23(29)30-16-9-7-15(8-10-16)22(27)28/h3-12,24H,1-2H3,(H,27,28)/b18-12+