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

Systemtic Name: 5-[(E)-(5-methoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-3-methyl-4-(phenylcarbonyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-benzoyl-5-[(E)-(5-methoxy-2-oxo-indolin-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-benzoyl-5-[(E)-(5-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-benzoyl-5-[(E)-(5-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-benzoyl-5-[(E)-(2-keto-5-methoxy-indolin-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid Formula: C23H18N2O5 MolecularWeight: 402.39942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C2=CC=CC=C2)C=C3C4=C(C=CC(=C4)OC)NC3=O)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1C(=O)C2=CC=CC=C2)/C=C/3\C4=C(C=CC(=C4)OC)NC3=O)C(=O)O

InChI

InChI=1S/C23H18N2O5/c1-12-19(21(26)13-6-4-3-5-7-13)18(24-20(12)23(28)29)11-16-15-10-14(30-2)8-9-17(15)25-22(16)27/h3-11,24H,1-2H3,(H,25,27)(H,28,29)/b16-11+