(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitro-phenyl)acrylamide Formula: C17H13ClN2O5 MolecularWeight: 360.74852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN2O5/c1-10-2-4-12(8-14(10)20(22)23)19-16(21)5-3-11-6-13(18)17-15(7-11)24-9-25-17/h2-8H,9H2,1H3,(H,19,21)/b5-3+