1-[(3-nitrophenyl)methylsulfonyl]-4-[(E)-3-phenylprop-2-enyl]piperazine

Systemtic Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-[(E)-3-phenylprop-2-enyl]piperazine Openeye Name: 1-[(E)-cinnamyl]-4-[(3-nitrophenyl)methylsulfonyl]piperazine CAS Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-[(E)-3-phenylprop-2-enyl]piperazine IUPAC Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-[(E)-3-phenylprop-2-enyl]piperazine Traditional Name: 1-[(E)-cinnamyl]-4-(3-nitrobenzyl)sulfonyl-piperazine Formula: C20H23N3O4S MolecularWeight: 401.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)S(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)S(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4S/c24-23(25)20-10-4-8-19(16-20)17-28(26,27)22-14-12-21(13-15-22)11-5-9-18-6-2-1-3-7-18/h1-10,16H,11-15,17H2/b9-5+