N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[2-(2-furyl)-2-(1-piperidyl)ethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-[2-(2-furyl)-2-piperidino-ethyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CO4

Isomeric SMILES

C1CCN(CC1)C(CNC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CO4

InChI

InChI=1S/C21H23N5O4/c27-21(18-9-12-25(23-18)16-6-4-7-17(14-16)26(28)29)22-15-19(20-8-5-13-30-20)24-10-2-1-3-11-24/h4-9,12-14,19H,1-3,10-11,15H2,(H,22,27)