3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-2,3-dihydro-1-benzofuran-5-carboximidamide

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-2,3-dihydro-1-benzofuran-5-carboximidamide Openeye Name: 3-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-2,3-dihydrobenzofuran-5-carboxamidine CAS Name: 3-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-2,3-dihydrobenzofuran-5-carboximidamide IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2,3-dihydro-1-benzofuran-5-carboximidamide Traditional Name: 3-[2-(4-benzylpiperidino)-2-keto-ethyl]coumaran-5-carboxamidine Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CC3COC4=C3C=C(C=C4)C(=N)N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CC3COC4=C3C=C(C=C4)C(=N)N

InChI

InChI=1S/C23H27N3O2/c24-23(25)18-6-7-21-20(13-18)19(15-28-21)14-22(27)26-10-8-17(9-11-26)12-16-4-2-1-3-5-16/h1-7,13,17,19H,8-12,14-15H2,(H3,24,25)