N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(1-piperidylmethyl)furan-2-carboxamide CAS Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(1-piperidinylmethyl)-2-furancarboxamide IUPAC Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(piperidin-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(piperidinomethyl)-2-furamide Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4CCCCC4)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4CCCCC4)C)C

InChI

InChI=1S/C26H29N3O5/c1-17-11-18(2)19(3)25(12-17)34-23-14-20(13-21(15-23)29(31)32)27-26(30)24-8-7-22(33-24)16-28-9-5-4-6-10-28/h7-8,11-15H,4-6,9-10,16H2,1-3H3,(H,27,30)