N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethanamide

Systemtic Name: N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethanamide Openeye Name: N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)acetamide CAS Name: N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(4-phenyl-1-piperazinyl)acetamide IUPAC Name: N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)acetamide Traditional Name: N-cyclopentyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazino)acetamide Formula: C24H28N4O5 MolecularWeight: 452.50292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)NC(=O)C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H28N4O5/c29-24(25-17-6-4-5-7-17)23(19-14-21-22(33-16-32-21)15-20(19)28(30)31)27-12-10-26(11-13-27)18-8-2-1-3-9-18/h1-3,8-9,14-15,17,23H,4-7,10-13,16H2,(H,25,29)