methyl 1-[(3,6,7-trimethyl-1-benzofuran-2-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(3,6,7-trimethyl-1-benzofuran-2-yl)carbonyl]piperidine-4-carboxylate Openeye Name: methyl 1-(3,6,7-trimethylbenzofuran-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo-(3,6,7-trimethyl-2-benzofuranyl)methyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3,6,7-trimethyl-1-benzofuran-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(3,6,7-trimethylbenzofuran-2-carbonyl)isonipecotic acid methyl ester Formula: C19H23NO4 MolecularWeight: 329.39022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=C(O2)C(=O)N3CCC(CC3)C(=O)OC)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=C(O2)C(=O)N3CCC(CC3)C(=O)OC)C)C

InChI

InChI=1S/C19H23NO4/c1-11-5-6-15-13(3)17(24-16(15)12(11)2)18(21)20-9-7-14(8-10-20)19(22)23-4/h5-6,14H,7-10H2,1-4H3