methyl 1-[(7-chloranyl-3,5-dimethyl-1-benzofuran-2-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(7-chloranyl-3,5-dimethyl-1-benzofuran-2-yl)carbonyl]piperidine-4-carboxylate Openeye Name: methyl 1-(7-chloro-3,5-dimethyl-benzofuran-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(7-chloro-3,5-dimethyl-2-benzofuranyl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(7-chloro-3,5-dimethyl-1-benzofuran-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(7-chloro-3,5-dimethyl-benzofuran-2-carbonyl)isonipecotic acid methyl ester Formula: C18H20ClNO4 MolecularWeight: 349.8087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)N3CCC(CC3)C(=O)OC)C)Cl

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)N3CCC(CC3)C(=O)OC)C)Cl

InChI

InChI=1S/C18H20ClNO4/c1-10-8-13-11(2)15(24-16(13)14(19)9-10)17(21)20-6-4-12(5-7-20)18(22)23-3/h8-9,12H,4-7H2,1-3H3