methyl 7-(2-azanylpropyl)-4-chloranyl-1-benzofuran-5-carboxylate

Systemtic Name: methyl 7-(2-azanylpropyl)-4-chloranyl-1-benzofuran-5-carboxylate Openeye Name: methyl 7-(2-aminopropyl)-4-chloro-benzofuran-5-carboxylate CAS Name: 7-(2-aminopropyl)-4-chloro-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 7-(2-aminopropyl)-4-chloro-1-benzofuran-5-carboxylate Traditional Name: 7-(2-aminopropyl)-4-chloro-benzofuran-5-carboxylic acid methyl ester Formula: C13H14ClNO3 MolecularWeight: 267.70816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C2C(=C(C(=C1)C(=O)OC)Cl)C=CO2)N

Isomeric SMILES

CC(CC1=C2C(=C(C(=C1)C(=O)OC)Cl)C=CO2)N

InChI

InChI=1S/C13H14ClNO3/c1-7(15)5-8-6-10(13(16)17-2)11(14)9-3-4-18-12(8)9/h3-4,6-7H,5,15H2,1-2H3