(E)-3-(1H-indol-3-yl)-N-[2-(methylamino)-5-nitro-phenyl]prop-2-enamide

Systemtic Name: (E)-3-(1H-indol-3-yl)-N-[2-(methylamino)-5-nitro-phenyl]prop-2-enamide Openeye Name: (E)-3-(1H-indol-3-yl)-N-[2-(methylamino)-5-nitro-phenyl]prop-2-enamide CAS Name: (E)-3-(1H-indol-3-yl)-N-[2-(methylamino)-5-nitrophenyl]-2-propenamide IUPAC Name: (E)-3-(1H-indol-3-yl)-N-[2-(methylamino)-5-nitrophenyl]prop-2-enamide Traditional Name: (E)-3-(1H-indol-3-yl)-N-[2-(methylamino)-5-nitro-phenyl]acrylamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C=CC2=CNC3=CC=CC=C32

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)/C=C/C2=CNC3=CC=CC=C32

InChI

InChI=1S/C18H16N4O3/c1-19-16-8-7-13(22(24)25)10-17(16)21-18(23)9-6-12-11-20-15-5-3-2-4-14(12)15/h2-11,19-20H,1H3,(H,21,23)/b9-6+