4-(2-carboxyethyl)-3-methyl-1-[(E)-(5-methyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]pyrrole-2-carboxylic acid

Systemtic Name: 4-(2-carboxyethyl)-3-methyl-1-[(E)-(5-methyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]pyrrole-2-carboxylic acid Openeye Name: 4-(2-carboxyethyl)-3-methyl-1-[(E)-(5-methyl-2-oxo-indolin-3-ylidene)methyl]pyrrole-2-carboxylic acid CAS Name: 4-(2-carboxyethyl)-3-methyl-1-[(E)-(5-methyl-2-oxo-1H-indol-3-ylidene)methyl]-2-pyrrolecarboxylic acid IUPAC Name: 4-(2-carboxyethyl)-3-methyl-1-[(E)-(5-methyl-2-oxo-1H-indol-3-ylidene)methyl]pyrrole-2-carboxylic acid Traditional Name: 4-(2-carboxyethyl)-1-[(E)-(2-keto-5-methyl-indolin-3-ylidene)methyl]-3-methyl-pyrrole-2-carboxylic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C2=CN3C=C(C(=C3C(=O)O)C)CCC(=O)O

Isomeric SMILES

CC1=CC\2=C(C=C1)NC(=O)/C2=C/N3C=C(C(=C3C(=O)O)C)CCC(=O)O

InChI

InChI=1S/C19H18N2O5/c1-10-3-5-15-13(7-10)14(18(24)20-15)9-21-8-12(4-6-16(22)23)11(2)17(21)19(25)26/h3,5,7-9H,4,6H2,1-2H3,(H,20,24)(H,22,23)(H,25,26)/b14-9+