(E)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-(4-chloro-2-methoxy-5-methylphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-(4-chloro-2-methoxy-5-methylphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C18H15ClN2O6 MolecularWeight: 390.7745

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C18H15ClN2O6/c1-10-5-13(15(25-2)7-12(10)19)20-18(22)4-3-11-6-16-17(27-9-26-16)8-14(11)21(23)24/h3-8H,9H2,1-2H3,(H,20,22)/b4-3+