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

Systemtic Name: 4-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-3-nitro-benzamide Openeye Name: 4-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-3-nitro-benzamide CAS Name: 4-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-3-nitrobenzamide IUPAC Name: 4-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-3-nitrobenzamide Traditional Name: 4-[[ethyl(piperonyl)amino]methyl]-3-nitro-benzamide Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5/c1-2-20(9-12-3-6-16-17(7-12)26-11-25-16)10-14-5-4-13(18(19)22)8-15(14)21(23)24/h3-8H,2,9-11H2,1H3,(H2,19,22)