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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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