[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone

Systemtic Name: [4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone Openeye Name: [4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone CAS Name: [4-[2-(4-chlorophenoxy)ethyl]-1-piperazinyl]-(3-methyl-2-nitrophenyl)methanone IUPAC Name: [4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-(3-methyl-2-nitrophenyl)methanone Traditional Name: [4-[2-(4-chlorophenoxy)ethyl]piperazino]-(3-methyl-2-nitro-phenyl)methanone Formula: C20H22ClN3O4 MolecularWeight: 403.85938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN3O4/c1-15-3-2-4-18(19(15)24(26)27)20(25)23-11-9-22(10-12-23)13-14-28-17-7-5-16(21)6-8-17/h2-8H,9-14H2,1H3