(E)-3-(4-nitrophenyl)-N-[6-(3-oxidanylpropylamino)pyridin-3-yl]prop-2-enamide

Systemtic Name: (E)-3-(4-nitrophenyl)-N-[6-(3-oxidanylpropylamino)pyridin-3-yl]prop-2-enamide Openeye Name: (E)-N-[6-(3-hydroxypropylamino)-3-pyridyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[6-(3-hydroxypropylamino)-3-pyridinyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[6-(3-hydroxypropylamino)pyridin-3-yl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[6-(3-hydroxypropylamino)-3-pyridyl]-3-(4-nitrophenyl)acrylamide Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC2=CN=C(C=C2)NCCCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NC2=CN=C(C=C2)NCCCO)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4/c22-11-1-10-18-16-8-5-14(12-19-16)20-17(23)9-4-13-2-6-15(7-3-13)21(24)25/h2-9,12,22H,1,10-11H2,(H,18,19)(H,20,23)/b9-4+