N-(3-chloranyl-2-morpholin-4-yl-phenyl)-6-nitro-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(3-chloranyl-2-morpholin-4-yl-phenyl)-6-nitro-1,3-benzodioxole-5-carboxamide Openeye Name: N-(3-chloro-2-morpholino-phenyl)-6-nitro-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-chloro-2-(4-morpholinyl)phenyl]-6-nitro-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(3-chloro-2-morpholin-4-ylphenyl)-6-nitro-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-chloro-2-morpholino-phenyl)-6-nitro-piperonylamide Formula: C18H16ClN3O6 MolecularWeight: 405.78914

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=C2Cl)NC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

C1COCCN1C2=C(C=CC=C2Cl)NC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C18H16ClN3O6/c19-12-2-1-3-13(17(12)21-4-6-26-7-5-21)20-18(23)11-8-15-16(28-10-27-15)9-14(11)22(24)25/h1-3,8-9H,4-7,10H2,(H,20,23)