6-bromanyl-5-(carboxymethyl)-2-methyl-1H-indole-3-carboxylic acid

Systemtic Name: 6-bromanyl-5-(carboxymethyl)-2-methyl-1H-indole-3-carboxylic acid Openeye Name: 6-bromo-5-(carboxymethyl)-2-methyl-1H-indole-3-carboxylic acid CAS Name: 6-bromo-5-(carboxymethyl)-2-methyl-1H-indole-3-carboxylic acid IUPAC Name: 6-bromo-5-(carboxymethyl)-2-methyl-1H-indole-3-carboxylic acid Traditional Name: 6-bromo-5-(carboxymethyl)-2-methyl-1H-indole-3-carboxylic acid Formula: C12H10BrNO4 MolecularWeight: 312.1161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2N1)Br)CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2N1)Br)CC(=O)O)C(=O)O

InChI

InChI=1S/C12H10BrNO4/c1-5-11(12(17)18)7-2-6(3-10(15)16)8(13)4-9(7)14-5/h2,4,14H,3H2,1H3,(H,15,16)(H,17,18)