N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-methyl-3-nitro-benzamide Openeye Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-methyl-3-nitro-benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-methyl-3-nitrobenzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-methyl-3-nitrobenzamide Traditional Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-methyl-3-nitro-benzamide Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O5/c1-10-3-4-13(7-14(10)20(22)23)17(21)19-18-11(2)12-5-6-15-16(8-12)25-9-24-15/h3-8H,9H2,1-2H3,(H,19,21)/b18-11+