[3-[1-(3-cyanopropyl)piperidin-4-yl]-2,2-dimethyl-3H-1-benzofuran-7-yl] carbamate

Systemtic Name: [3-[1-(3-cyanopropyl)piperidin-4-yl]-2,2-dimethyl-3H-1-benzofuran-7-yl] carbamate Openeye Name: [3-[1-(3-cyanopropyl)-4-piperidyl]-2,2-dimethyl-3H-benzofuran-7-yl] carbamate CAS Name: carbamic acid [3-[1-(3-cyanopropyl)-4-piperidinyl]-2,2-dimethyl-3H-benzofuran-7-yl] ester IUPAC Name: [3-[1-(3-cyanopropyl)piperidin-4-yl]-2,2-dimethyl-3H-1-benzofuran-7-yl] carbamate Traditional Name: carbamic acid [3-[1-(3-cyanopropyl)-4-piperidyl]-2,2-dimethyl-coumaran-7-yl] ester Formula: C20H27N3O3 MolecularWeight: 357.44668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=C(O1)C(=CC=C2)OC(=O)N)C3CCN(CC3)CCCC#N)C

Isomeric SMILES

CC1(C(C2=C(O1)C(=CC=C2)OC(=O)N)C3CCN(CC3)CCCC#N)C

InChI

InChI=1S/C20H27N3O3/c1-20(2)17(14-8-12-23(13-9-14)11-4-3-10-21)15-6-5-7-16(18(15)26-20)25-19(22)24/h5-7,14,17H,3-4,8-9,11-13H2,1-2H3,(H2,22,24)