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

Systemtic Name: N-[2-chloranyl-5-[5-(hydroxymethyl)furan-2-yl]phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[2-chloro-5-[5-(hydroxymethyl)-2-furyl]phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[2-chloro-5-[5-(hydroxymethyl)-2-furanyl]phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[2-chloro-5-[5-(hydroxymethyl)furan-2-yl]phenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[2-chloro-5-(5-methylol-2-furyl)phenyl]-4-ethoxy-3-nitro-benzamide Formula: C20H17ClN2O6 MolecularWeight: 416.81178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=CC=C(O3)CO)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=CC=C(O3)CO)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClN2O6/c1-2-28-19-7-4-13(10-17(19)23(26)27)20(25)22-16-9-12(3-6-15(16)21)18-8-5-14(11-24)29-18/h3-10,24H,2,11H2,1H3,(H,22,25)