(3E)-3-[[4-(2-carboxyethyl)-3-methyl-1H-pyrrol-2-yl]methylidene]-2-oxidanylidene-1H-indole-5-carboxylic acid

Systemtic Name: (3E)-3-[[4-(2-carboxyethyl)-3-methyl-1H-pyrrol-2-yl]methylidene]-2-oxidanylidene-1H-indole-5-carboxylic acid Openeye Name: (3E)-3-[[4-(2-carboxyethyl)-3-methyl-1H-pyrrol-2-yl]methylene]-2-oxo-indoline-5-carboxylic acid CAS Name: (3E)-3-[[4-(2-carboxyethyl)-3-methyl-1H-pyrrol-2-yl]methylidene]-2-oxo-1H-indole-5-carboxylic acid IUPAC Name: (3E)-3-[[4-(2-carboxyethyl)-3-methyl-1H-pyrrol-2-yl]methylidene]-2-oxo-1H-indole-5-carboxylic acid Traditional Name: (3E)-3-[[4-(2-carboxyethyl)-3-methyl-1H-pyrrol-2-yl]methylene]-2-keto-indoline-5-carboxylic acid Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC=C1CCC(=O)O)C=C2C3=C(C=CC(=C3)C(=O)O)NC2=O

Isomeric SMILES

CC1=C(NC=C1CCC(=O)O)/C=C/2\C3=C(C=CC(=C3)C(=O)O)NC2=O

InChI

InChI=1S/C18H16N2O5/c1-9-11(3-5-16(21)22)8-19-15(9)7-13-12-6-10(18(24)25)2-4-14(12)20-17(13)23/h2,4,6-8,19H,3,5H2,1H3,(H,20,23)(H,21,22)(H,24,25)/b13-7+