4-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-N-oxidanyl-butanamide

Systemtic Name: 4-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-N-oxidanyl-butanamide Openeye Name: (E)-N-[4-(hydroxyamino)-4-oxo-butyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: N-hydroxy-4-[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]butanamide IUPAC Name: N-hydroxy-4-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]butanamide Traditional Name: (E)-N-[4-(hydroxyamino)-4-keto-butyl]-3-(4-nitrophenyl)acrylamide Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NCCCC(=O)NO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NCCCC(=O)NO)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O5/c17-12(14-9-1-2-13(18)15-19)8-5-10-3-6-11(7-4-10)16(20)21/h3-8,19H,1-2,9H2,(H,14,17)(H,15,18)/b8-5+