(E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[(2S)-2-phenylpropyl]prop-2-enamide

Systemtic Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[(2S)-2-phenylpropyl]prop-2-enamide Openeye Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[(2S)-2-phenylpropyl]prop-2-enamide CAS Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[(2S)-2-phenylpropyl]-2-propenamide IUPAC Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[(2S)-2-phenylpropyl]prop-2-enamide Traditional Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[(2S)-2-phenylpropyl]acrylamide Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C=CC1=CC2=C(C=C1[N+](=O)[O-])OCO2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)/C=C/C1=CC2=C(C=C1[N+](=O)[O-])OCO2)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O5/c1-13(14-5-3-2-4-6-14)11-20-19(22)8-7-15-9-17-18(26-12-25-17)10-16(15)21(23)24/h2-10,13H,11-12H2,1H3,(H,20,22)/b8-7+/t13-/m1/s1