2-chloranyl-N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[[1-(2-furylmethyl)-4-piperidyl]methyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[[1-(2-furanylmethyl)-4-piperidinyl]methyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[[1-(2-furfuryl)-4-piperidyl]methyl]-4-nitro-benzamide Formula: C18H20ClN3O4 MolecularWeight: 377.8221

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)CC3=CC=CO3

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)CC3=CC=CO3

InChI

InChI=1S/C18H20ClN3O4/c19-17-10-14(22(24)25)3-4-16(17)18(23)20-11-13-5-7-21(8-6-13)12-15-2-1-9-26-15/h1-4,9-10,13H,5-8,11-12H2,(H,20,23)