2-[(5-nitro-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine

Systemtic Name: 2-[(5-nitro-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine Openeye Name: 2-[(5-nitro-2,3-dihydrobenzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine CAS Name: 2-[(5-nitro-2,3-dihydrobenzofuran-7-yl)methyl]-2-phenyl-1-piperidinamine IUPAC Name: 2-[(5-nitro-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenylpiperidin-1-amine Traditional Name: [2-[(5-nitrocoumaran-7-yl)methyl]-2-phenyl-piperidino]amine Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)(CC2=C3C(=CC(=C2)[N+](=O)[O-])CCO3)C4=CC=CC=C4)N

Isomeric SMILES

C1CCN(C(C1)(CC2=C3C(=CC(=C2)[N+](=O)[O-])CCO3)C4=CC=CC=C4)N

InChI

InChI=1S/C20H23N3O3/c21-22-10-5-4-9-20(22,17-6-2-1-3-7-17)14-16-13-18(23(24)25)12-15-8-11-26-19(15)16/h1-3,6-7,12-13H,4-5,8-11,14,21H2