2-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[4-[(2-nitrophenyl)methyl]-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-[4-(2-nitrobenzyl)piperazino]cyclohepta-2,4,6-trien-1-one Formula: C18H19N3O3 MolecularWeight: 325.36176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=CC3=O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=CC3=O

InChI

InChI=1S/C18H19N3O3/c22-18-9-3-1-2-8-17(18)20-12-10-19(11-13-20)14-15-6-4-5-7-16(15)21(23)24/h1-9H,10-14H2