(E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(phenylmethyl)-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(phenylmethyl)-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-N-benzyl-N-isopropyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(phenylmethyl)-N-propan-2-yl-2-propenamide IUPAC Name: (E)-N-benzyl-3-(6-nitro-1,3-benzodioxol-5-yl)-N-propan-2-ylprop-2-enamide Traditional Name: (E)-N-benzyl-N-isopropyl-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C20H20N2O5/c1-14(2)21(12-15-6-4-3-5-7-15)20(23)9-8-16-10-18-19(27-13-26-18)11-17(16)22(24)25/h3-11,14H,12-13H2,1-2H3/b9-8+