3-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-indol-1-yl]carbonyloxy-2-oxidanyl-propanoic acid

Systemtic Name: 3-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-indol-1-yl]carbonyloxy-2-oxidanyl-propanoic acid Openeye Name: 3-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylene]-2-oxo-indoline-1-carbonyl]oxy-2-hydroxy-propanoic acid CAS Name: 3-[[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxo-1-indolyl]-oxomethoxy]-2-hydroxypropanoic acid IUPAC Name: 3-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxoindole-1-carbonyl]oxy-2-hydroxypropanoic acid Traditional Name: 3-[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylene]-2-keto-indoline-1-carbonyl]oxy-2-hydroxy-propionic acid Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C=C2C3=CC=CC=C3N(C2=O)C(=O)OCC(C(=O)O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O6/c1-10-7-11(2)20-14(10)8-13-12-5-3-4-6-15(12)21(17(13)23)19(26)27-9-16(22)18(24)25/h3-8,16,20,22H,9H2,1-2H3,(H,24,25)/b13-8+