5-(bromomethyl)-1-(2-ethoxycarbonylphenyl)indole-2-carboxylic acid

Systemtic Name: 5-(bromomethyl)-1-(2-ethoxycarbonylphenyl)indole-2-carboxylic acid Openeye Name: 5-(bromomethyl)-1-(2-ethoxycarbonylphenyl)indole-2-carboxylic acid CAS Name: 5-(bromomethyl)-1-(2-ethoxycarbonylphenyl)-2-indolecarboxylic acid IUPAC Name: 5-(bromomethyl)-1-(2-ethoxycarbonylphenyl)indole-2-carboxylic acid Traditional Name: 5-(bromomethyl)-1-(2-carbethoxyphenyl)indole-2-carboxylic acid Formula: C19H16BrNO4 MolecularWeight: 402.23864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1N2C3=C(C=C(C=C3)CBr)C=C2C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1N2C3=C(C=C(C=C3)CBr)C=C2C(=O)O

InChI

InChI=1S/C19H16BrNO4/c1-2-25-19(24)14-5-3-4-6-16(14)21-15-8-7-12(11-20)9-13(15)10-17(21)18(22)23/h3-10H,2,11H2,1H3,(H,22,23)