N-(1,3-benzodioxol-5-ylmethyl)-2-(4-nitrophenyl)-N-(phenylmethyl)ethanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-nitrophenyl)-N-(phenylmethyl)ethanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-benzyl-2-(4-nitrophenyl)ethanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-nitrophenyl)-N-(phenylmethyl)ethanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-benzyl-2-(4-nitrophenyl)ethanamine Traditional Name: benzyl-[2-(4-nitrophenyl)ethyl]-piperonyl-amine Formula: C23H22N2O4 MolecularWeight: 390.43178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(CCC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(CCC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O4/c26-25(27)21-9-6-18(7-10-21)12-13-24(15-19-4-2-1-3-5-19)16-20-8-11-22-23(14-20)29-17-28-22/h1-11,14H,12-13,15-17H2