N-[(5-nitro-2-oxidanyl-phenyl)methyl]-3-(2-phenylethanoylamino)propanamide

Systemtic Name: N-[(5-nitro-2-oxidanyl-phenyl)methyl]-3-(2-phenylethanoylamino)propanamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-3-[(2-phenylacetyl)amino]propanamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-[(1-oxo-2-phenylethyl)amino]propanamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-[(2-phenylacetyl)amino]propanamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-3-[(2-phenylacetyl)amino]propionamide Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NCCC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NCCC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H19N3O5/c22-16-7-6-15(21(25)26)11-14(16)12-20-17(23)8-9-19-18(24)10-13-4-2-1-3-5-13/h1-7,11,22H,8-10,12H2,(H,19,24)(H,20,23)