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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-nitro-4-[(phenylmethyl)amino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(benzylamino)-3-nitro-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-nitro-4-[(phenylmethyl)amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(benzylamino)-3-nitrobenzamide Traditional Name: 4-(benzylamino)-3-nitro-N-piperonyl-benzamide Formula: C22H19N3O5 MolecularWeight: 405.40336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

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