N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyethylamino)-5-nitro-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyethylamino)-5-nitro-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyethylamino)-5-nitro-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyethylamino)-5-nitrobenzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyethylamino)-5-nitrobenzamide Traditional Name: 2-(2-methoxyethylamino)-5-nitro-N-piperonyl-benzamide Formula: C18H19N3O6 MolecularWeight: 373.35996

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19N3O6/c1-25-7-6-19-15-4-3-13(21(23)24)9-14(15)18(22)20-10-12-2-5-16-17(8-12)27-11-26-16/h2-5,8-9,19H,6-7,10-11H2,1H3,(H,20,22)