5-[(E)-(6-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 5-[(E)-(6-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid Openeye Name: 5-[(E)-(6-bromo-2-oxo-indolin-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid CAS Name: 5-[(E)-(6-bromo-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid IUPAC Name: 5-[(E)-(6-bromo-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid Traditional Name: 5-[(E)-(6-bromo-2-keto-indolin-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid Formula: C16H13BrN2O3 MolecularWeight: 361.19002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)O)C)C=C2C3=C(C=C(C=C3)Br)NC2=O

Isomeric SMILES

CC1=C(NC(=C1C(=O)O)C)/C=C/2\C3=C(C=C(C=C3)Br)NC2=O

InChI

InChI=1S/C16H13BrN2O3/c1-7-12(18-8(2)14(7)16(21)22)6-11-10-4-3-9(17)5-13(10)19-15(11)20/h3-6,18H,1-2H3,(H,19,20)(H,21,22)/b11-6+