N-(1,3-benzodioxol-5-yl)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-morpholino-3-nitro-benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-morpholino-3-nitro-benzamide Formula: C18H17N3O6 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O6/c22-18(19-13-2-4-16-17(10-13)27-11-26-16)12-1-3-14(15(9-12)21(23)24)20-5-7-25-8-6-20/h1-4,9-10H,5-8,11H2,(H,19,22)