5-[(E)-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]-4-phenyl-2-propan-2-yl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 5-[(E)-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]-4-phenyl-2-propan-2-yl-1H-pyrrole-3-carboxylic acid Openeye Name: 5-[(E)-(5-bromo-2-oxo-indolin-3-ylidene)methyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid CAS Name: 5-[(E)-(5-bromo-2-oxo-1H-indol-3-ylidene)methyl]-4-phenyl-2-propan-2-yl-1H-pyrrole-3-carboxylic acid IUPAC Name: 5-[(E)-(5-bromo-2-oxo-1H-indol-3-ylidene)methyl]-4-phenyl-2-propan-2-yl-1H-pyrrole-3-carboxylic acid Traditional Name: 5-[(E)-(5-bromo-2-keto-indolin-3-ylidene)methyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid Formula: C23H19BrN2O3 MolecularWeight: 451.31256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(N1)C=C2C3=C(C=CC(=C3)Br)NC2=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C)C1=C(C(=C(N1)/C=C/2\C3=C(C=CC(=C3)Br)NC2=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H19BrN2O3/c1-12(2)21-20(23(28)29)19(13-6-4-3-5-7-13)18(25-21)11-16-15-10-14(24)8-9-17(15)26-22(16)27/h3-12,25H,1-2H3,(H,26,27)(H,28,29)/b16-11+