3-nitro-N-[(E)-1-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-yl)ethylideneamino]benzamide

Systemtic Name: 3-nitro-N-[(E)-1-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-yl)ethylideneamino]benzamide Openeye Name: 3-nitro-N-[(E)-1-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-yl)ethylideneamino]benzamide CAS Name: 3-nitro-N-[(E)-1-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-yl)ethylideneamino]benzamide IUPAC Name: 3-nitro-N-[(E)-1-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-yl)ethylideneamino]benzamide Traditional Name: 3-nitro-N-[(E)-1-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-yl)ethylideneamino]benzamide Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC3=C(C=C2)OCCCCO3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)[N+](=O)[O-])/C2=CC3=C(C=C2)OCCCCO3

InChI

InChI=1S/C19H19N3O5/c1-13(14-7-8-17-18(12-14)27-10-3-2-9-26-17)20-21-19(23)15-5-4-6-16(11-15)22(24)25/h4-8,11-12H,2-3,9-10H2,1H3,(H,21,23)/b20-13+