1-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]urea CAS Name: 1-[2-[4-(4-nitrophenyl)-1-piperazinyl]-2-oxoethyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl]urea Traditional Name: 1-benzyl-3-[2-keto-2-[4-(4-nitrophenyl)piperazino]ethyl]urea Formula: C20H23N5O4 MolecularWeight: 397.42772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H23N5O4/c26-19(15-22-20(27)21-14-16-4-2-1-3-5-16)24-12-10-23(11-13-24)17-6-8-18(9-7-17)25(28)29/h1-9H,10-15H2,(H2,21,22,27)