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

Systemtic Name: 2-[(E)-[4-(3-bromophenyl)-2-oxidanylidene-1H-indol-3-ylidene]methyl]-5-methyl-1H-pyrrole-3-carboxylic acid Openeye Name: 2-[(E)-[4-(3-bromophenyl)-2-oxo-indolin-3-ylidene]methyl]-5-methyl-1H-pyrrole-3-carboxylic acid CAS Name: 2-[(E)-[4-(3-bromophenyl)-2-oxo-1H-indol-3-ylidene]methyl]-5-methyl-1H-pyrrole-3-carboxylic acid IUPAC Name: 2-[(E)-[4-(3-bromophenyl)-2-oxo-1H-indol-3-ylidene]methyl]-5-methyl-1H-pyrrole-3-carboxylic acid Traditional Name: 2-[(E)-[4-(3-bromophenyl)-2-keto-indolin-3-ylidene]methyl]-5-methyl-1H-pyrrole-3-carboxylic acid Formula: C21H15BrN2O3 MolecularWeight: 423.2594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C=C2C3=C(C=CC=C3NC2=O)C4=CC(=CC=C4)Br)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1)/C=C/2\C3=C(C=CC=C3NC2=O)C4=CC(=CC=C4)Br)C(=O)O

InChI

InChI=1S/C21H15BrN2O3/c1-11-8-15(21(26)27)18(23-11)10-16-19-14(12-4-2-5-13(22)9-12)6-3-7-17(19)24-20(16)25/h2-10,23H,1H3,(H,24,25)(H,26,27)/b16-10+