(3R)-N-[(Z)-1-(3-nitrophenyl)butylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[(Z)-1-(3-nitrophenyl)butylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[(Z)-1-(3-nitrophenyl)butylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[(Z)-1-(3-nitrophenyl)butylideneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[(Z)-1-(3-nitrophenyl)butylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-[(Z)-1-(3-nitrophenyl)butylideneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=O)C1COC2=CC=CC=C2O1)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC/C(=N/NC(=O)[C@H]1COC2=CC=CC=C2O1)/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c1-2-6-15(13-7-5-8-14(11-13)22(24)25)20-21-19(23)18-12-26-16-9-3-4-10-17(16)27-18/h3-5,7-11,18H,2,6,12H2,1H3,(H,21,23)/b20-15-/t18-/m1/s1