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

Systemtic Name: 4-chloranyl-N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxy-phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[3-[5-(hydroxymethyl)-2-furyl]-4-methoxy-phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[3-[5-(hydroxymethyl)-2-furanyl]-4-methoxyphenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-methoxy-3-(5-methylol-2-furyl)phenyl]-3-nitro-benzamide Formula: C19H15ClN2O6 MolecularWeight: 402.7852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15ClN2O6/c1-27-17-6-3-12(9-14(17)18-7-4-13(10-23)28-18)21-19(24)11-2-5-15(20)16(8-11)22(25)26/h2-9,23H,10H2,1H3,(H,21,24)