N-[(Z)-1-[(2S)-3,3-dimethyl-2H-1,4-benzodioxin-2-yl]ethylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(Z)-1-[(2S)-3,3-dimethyl-2H-1,4-benzodioxin-2-yl]ethylideneamino]-4-nitro-benzamide Openeye Name: N-[(Z)-1-[(2S)-3,3-dimethyl-2H-1,4-benzodioxin-2-yl]ethylideneamino]-4-nitro-benzamide CAS Name: N-[(Z)-1-[(2S)-3,3-dimethyl-2H-1,4-benzodioxin-2-yl]ethylideneamino]-4-nitrobenzamide IUPAC Name: N-[(Z)-1-[(2S)-3,3-dimethyl-2H-1,4-benzodioxin-2-yl]ethylideneamino]-4-nitrobenzamide Traditional Name: N-[(Z)-1-[(2S)-3,3-dimethyl-2H-1,4-benzodioxin-2-yl]ethylideneamino]-4-nitro-benzamide Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])C2C(OC3=CC=CC=C3O2)(C)C

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])/[C@H]2C(OC3=CC=CC=C3O2)(C)C

InChI

InChI=1S/C19H19N3O5/c1-12(17-19(2,3)27-16-7-5-4-6-15(16)26-17)20-21-18(23)13-8-10-14(11-9-13)22(24)25/h4-11,17H,1-3H3,(H,21,23)/b20-12-/t17-/m0/s1