4-(bromomethyl)-9-ethanoyl-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 4-(bromomethyl)-9-ethanoyl-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 9-acetyl-4-(bromomethyl)pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 9-acetyl-4-(bromomethyl)-3-pyrido[3,4-b]indolecarboxylic acid IUPAC Name: 9-acetyl-4-(bromomethyl)pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 9-acetyl-4-(bromomethyl)-$b-carboline-3-carboxylic acid Formula: C15H11BrN2O3 MolecularWeight: 347.16344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC=CC=C2C3=C(C(=NC=C31)C(=O)O)CBr

Isomeric SMILES

CC(=O)N1C2=CC=CC=C2C3=C(C(=NC=C31)C(=O)O)CBr

InChI

InChI=1S/C15H11BrN2O3/c1-8(19)18-11-5-3-2-4-9(11)13-10(6-16)14(15(20)21)17-7-12(13)18/h2-5,7H,6H2,1H3,(H,20,21)