1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-(4-methyl-2-nitro-phenoxy)propan-1-one

Systemtic Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-(4-methyl-2-nitro-phenoxy)propan-1-one Openeye Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-(4-methyl-2-nitro-phenoxy)propan-1-one CAS Name: 1-[4-(2-hydroxyethyl)-1-piperazinyl]-3-(4-methyl-2-nitrophenoxy)-1-propanone IUPAC Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-(4-methyl-2-nitrophenoxy)propan-1-one Traditional Name: 1-[4-(2-hydroxyethyl)piperazino]-3-(4-methyl-2-nitro-phenoxy)propan-1-one Formula: C16H23N3O5 MolecularWeight: 337.37092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCC(=O)N2CCN(CC2)CCO)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCCC(=O)N2CCN(CC2)CCO)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O5/c1-13-2-3-15(14(12-13)19(22)23)24-11-4-16(21)18-7-5-17(6-8-18)9-10-20/h2-3,12,20H,4-11H2,1H3