N-(5-nitro-2-oxidanyl-phenyl)-4-propyl-benzamide

Systemtic Name: N-(5-nitro-2-oxidanyl-phenyl)-4-propyl-benzamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)-4-propyl-benzamide CAS Name: N-(2-hydroxy-5-nitrophenyl)-4-propylbenzamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)-4-propylbenzamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)-4-propyl-benzamide Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H16N2O4/c1-2-3-11-4-6-12(7-5-11)16(20)17-14-10-13(18(21)22)8-9-15(14)19/h4-10,19H,2-3H2,1H3,(H,17,20)