N-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enylidene]amino]-4-nitro-benzamide

Systemtic Name: N-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enylidene]amino]-4-nitro-benzamide Openeye Name: N-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enylidene]amino]-4-nitro-benzamide CAS Name: N-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enylidene]amino]-4-nitrobenzamide IUPAC Name: N-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enylidene]amino]-4-nitrobenzamide Traditional Name: N-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enylidene]amino]-4-nitro-benzamide Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5/c21-17(13-4-6-14(7-5-13)20(22)23)19-18-9-1-2-12-3-8-15-16(10-12)25-11-24-15/h1-10H,11H2,(H,19,21)/b2-1+,18-9?