N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-4-nitro-3-oxidanyl-benzamide Openeye Name: N-[2-(2-furyl)-2-(1-piperidyl)ethyl]-3-hydroxy-4-nitro-benzamide CAS Name: N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]-3-hydroxy-4-nitrobenzamide IUPAC Name: N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-hydroxy-4-nitrobenzamide Traditional Name: N-[2-(2-furyl)-2-piperidino-ethyl]-3-hydroxy-4-nitro-benzamide Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O)C3=CC=CO3

Isomeric SMILES

C1CCN(CC1)C(CNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O)C3=CC=CO3

InChI

InChI=1S/C18H21N3O5/c22-16-11-13(6-7-14(16)21(24)25)18(23)19-12-15(17-5-4-10-26-17)20-8-2-1-3-9-20/h4-7,10-11,15,22H,1-3,8-9,12H2,(H,19,23)