4-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-cyclopropyl-3-nitro-benzamide

Systemtic Name: 4-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-cyclopropyl-3-nitro-benzamide Openeye Name: 4-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-cyclopropyl-3-nitro-benzamide CAS Name: 4-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-cyclopropyl-3-nitrobenzamide IUPAC Name: 4-[2-(1,3-benzodioxol-5-yl)ethylamino]-N-cyclopropyl-3-nitrobenzamide Traditional Name: N-cyclopropyl-4-(homopiperonylamino)-3-nitro-benzamide Formula: C19H19N3O5 MolecularWeight: 369.37126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=C(C=C2)NCCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=C(C=C2)NCCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c23-19(21-14-3-4-14)13-2-5-15(16(10-13)22(24)25)20-8-7-12-1-6-17-18(9-12)27-11-26-17/h1-2,5-6,9-10,14,20H,3-4,7-8,11H2,(H,21,23)