4-[(1,3-benzodioxol-5-ylmethylamino)methyl]-N-(2-nitrophenyl)benzamide

Systemtic Name: 4-[(1,3-benzodioxol-5-ylmethylamino)methyl]-N-(2-nitrophenyl)benzamide Openeye Name: 4-[(1,3-benzodioxol-5-ylmethylamino)methyl]-N-(2-nitrophenyl)benzamide CAS Name: 4-[(1,3-benzodioxol-5-ylmethylamino)methyl]-N-(2-nitrophenyl)benzamide IUPAC Name: 4-[(1,3-benzodioxol-5-ylmethylamino)methyl]-N-(2-nitrophenyl)benzamide Traditional Name: N-(2-nitrophenyl)-4-[(piperonylamino)methyl]benzamide Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O5/c26-22(24-18-3-1-2-4-19(18)25(27)28)17-8-5-15(6-9-17)12-23-13-16-7-10-20-21(11-16)30-14-29-20/h1-11,23H,12-14H2,(H,24,26)