N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-3,4,5-trimethoxy-2-nitro-benzamide

Systemtic Name: N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: N-[2-(2-furyl)-2-(1-piperidyl)ethyl]-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: N-[2-(2-furyl)-2-piperidino-ethyl]-3,4,5-trimethoxy-2-nitro-benzamide Formula: C21H27N3O7 MolecularWeight: 433.45498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NCC(C2=CC=CO2)N3CCCCC3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NCC(C2=CC=CO2)N3CCCCC3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H27N3O7/c1-28-17-12-14(18(24(26)27)20(30-3)19(17)29-2)21(25)22-13-15(16-8-7-11-31-16)23-9-5-4-6-10-23/h7-8,11-12,15H,4-6,9-10,13H2,1-3H3,(H,22,25)