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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1)C(=O)O)C=C2C3=C(C=CC=C3NC2=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=C(NC(=C1)C(=O)O)/C=C/2\C3=C(C=CC=C3NC2=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H15BrN2O3/c1-11-8-18(21(26)27)23-17(11)10-15-19-14(12-4-2-5-13(22)9-12)6-3-7-16(19)24-20(15)25/h2-10,23H,1H3,(H,24,25)(H,26,27)/b15-10+