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

Systemtic Name: N-[1-(3-cyanopropyl)piperidin-4-yl]-2,2-dimethyl-3H-1-benzofuran-7-carboxamide Openeye Name: N-[1-(3-cyanopropyl)-4-piperidyl]-2,2-dimethyl-3H-benzofuran-7-carboxamide CAS Name: N-[1-(3-cyanopropyl)-4-piperidinyl]-2,2-dimethyl-3H-benzofuran-7-carboxamide IUPAC Name: N-[1-(3-cyanopropyl)piperidin-4-yl]-2,2-dimethyl-3H-1-benzofuran-7-carboxamide Traditional Name: N-[1-(3-cyanopropyl)-4-piperidyl]-2,2-dimethyl-coumaran-7-carboxamide Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC(=C2O1)C(=O)NC3CCN(CC3)CCCC#N)C

Isomeric SMILES

CC1(CC2=CC=CC(=C2O1)C(=O)NC3CCN(CC3)CCCC#N)C

InChI

InChI=1S/C20H27N3O2/c1-20(2)14-15-6-5-7-17(18(15)25-20)19(24)22-16-8-12-23(13-9-16)11-4-3-10-21/h5-7,16H,3-4,8-9,11-14H2,1-2H3,(H,22,24)