N-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-[methyl(piperonyl)amino]propyl]-4-nitro-benzamide Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O6/c1-21(11-13-2-7-16-17(10-13)28-12-27-16)18(23)8-9-20-19(24)14-3-5-15(6-4-14)22(25)26/h2-7,10H,8-9,11-12H2,1H3,(H,20,24)