N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methyl-phenyl]-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methyl-phenyl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[5-[5-(hydroxymethyl)-2-furyl]-2-methyl-phenyl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[5-[5-(hydroxymethyl)-2-furanyl]-2-methylphenyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methylphenyl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[2-methyl-5-(5-methylol-2-furyl)phenyl]-5-nitro-2-piperidino-benzamide Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCCC4

InChI

InChI=1S/C24H25N3O5/c1-16-5-6-17(23-10-8-19(15-28)32-23)13-21(16)25-24(29)20-14-18(27(30)31)7-9-22(20)26-11-3-2-4-12-26/h5-10,13-14,28H,2-4,11-12,15H2,1H3,(H,25,29)