(E)-3-(2-azanyl-5-oxidanyl-phenyl)-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]prop-2-enamide

Systemtic Name: (E)-3-(2-azanyl-5-oxidanyl-phenyl)-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]prop-2-enamide Openeye Name: (E)-3-(2-amino-5-hydroxy-phenyl)-N-[2-[(5-nitro-2-pyridyl)amino]ethyl]prop-2-enamide CAS Name: (E)-3-(2-amino-5-hydroxyphenyl)-N-[2-[(5-nitro-2-pyridinyl)amino]ethyl]-2-propenamide IUPAC Name: (E)-3-(2-amino-5-hydroxyphenyl)-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]prop-2-enamide Traditional Name: (E)-3-(2-amino-5-hydroxy-phenyl)-N-[2-[(5-nitro-2-pyridyl)amino]ethyl]acrylamide Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)C=CC(=O)NCCNC2=NC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1O)/C=C/C(=O)NCCNC2=NC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C16H17N5O4/c17-14-4-3-13(22)9-11(14)1-6-16(23)19-8-7-18-15-5-2-12(10-20-15)21(24)25/h1-6,9-10,22H,7-8,17H2,(H,18,20)(H,19,23)/b6-1+