(2S)-N-(2-methoxy-5-nitro-phenyl)-2-(4-phenylpiperazin-1-yl)propanamide

Systemtic Name: (2S)-N-(2-methoxy-5-nitro-phenyl)-2-(4-phenylpiperazin-1-yl)propanamide Openeye Name: (2S)-N-(2-methoxy-5-nitro-phenyl)-2-(4-phenylpiperazin-1-yl)propanamide CAS Name: (2S)-N-(2-methoxy-5-nitrophenyl)-2-(4-phenyl-1-piperazinyl)propanamide IUPAC Name: (2S)-N-(2-methoxy-5-nitrophenyl)-2-(4-phenylpiperazin-1-yl)propanamide Traditional Name: (2S)-N-(2-methoxy-5-nitro-phenyl)-2-(4-phenylpiperazino)propionamide Formula: C20H24N4O4 MolecularWeight: 384.42896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4O4/c1-15(22-10-12-23(13-11-22)16-6-4-3-5-7-16)20(25)21-18-14-17(24(26)27)8-9-19(18)28-2/h3-9,14-15H,10-13H2,1-2H3,(H,21,25)/t15-/m0/s1