5-[(3-methyl-4-nitro-phenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]furan-2-carboxamide

Systemtic Name: 5-[(3-methyl-4-nitro-phenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]furan-2-carboxamide Openeye Name: 5-[(3-methyl-4-nitro-phenoxy)methyl]-N-[4-(1-piperidylmethyl)phenyl]furan-2-carboxamide CAS Name: 5-[(3-methyl-4-nitrophenoxy)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-2-furancarboxamide IUPAC Name: 5-[(3-methyl-4-nitrophenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]furan-2-carboxamide Traditional Name: 5-[(3-methyl-4-nitro-phenoxy)methyl]-N-[4-(piperidinomethyl)phenyl]-2-furamide Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)CN4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)CN4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C25H27N3O5/c1-18-15-21(9-11-23(18)28(30)31)32-17-22-10-12-24(33-22)25(29)26-20-7-5-19(6-8-20)16-27-13-3-2-4-14-27/h5-12,15H,2-4,13-14,16-17H2,1H3,(H,26,29)