4-(bromomethyl)-9-ethanoyl-5-propan-2-yloxy-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 4-(bromomethyl)-9-ethanoyl-5-propan-2-yloxy-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 9-acetyl-4-(bromomethyl)-5-isopropoxy-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 9-acetyl-4-(bromomethyl)-5-propan-2-yloxy-3-pyrido[3,4-b]indolecarboxylic acid IUPAC Name: 9-acetyl-4-(bromomethyl)-5-propan-2-yloxypyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 9-acetyl-4-(bromomethyl)-5-isopropoxy-$b-carboline-3-carboxylic acid Formula: C18H17BrN2O4 MolecularWeight: 405.24258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC2=C1C3=C(C(=NC=C3N2C(=O)C)C(=O)O)CBr

Isomeric SMILES

CC(C)OC1=CC=CC2=C1C3=C(C(=NC=C3N2C(=O)C)C(=O)O)CBr

InChI

InChI=1S/C18H17BrN2O4/c1-9(2)25-14-6-4-5-12-16(14)15-11(7-19)17(18(23)24)20-8-13(15)21(12)10(3)22/h4-6,8-9H,7H2,1-3H3,(H,23,24)