N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxy-phenyl]-4-nitro-benzamide

Systemtic Name: N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxy-phenyl]-4-nitro-benzamide Openeye Name: N-[3-[5-(hydroxymethyl)-2-furyl]-4-methoxy-phenyl]-4-nitro-benzamide CAS Name: N-[3-[5-(hydroxymethyl)-2-furanyl]-4-methoxyphenyl]-4-nitrobenzamide IUPAC Name: N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-4-nitrobenzamide Traditional Name: N-[4-methoxy-3-(5-methylol-2-furyl)phenyl]-4-nitro-benzamide Formula: C19H16N2O6 MolecularWeight: 368.34014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(O3)CO

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(O3)CO

InChI

InChI=1S/C19H16N2O6/c1-26-17-8-4-13(10-16(17)18-9-7-15(11-22)27-18)20-19(23)12-2-5-14(6-3-12)21(24)25/h2-10,22H,11H2,1H3,(H,20,23)