[4-(4-ethanoylpiperazin-1-yl)phenyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [4-(4-ethanoylpiperazin-1-yl)phenyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate Openeye Name: [4-(4-acetylpiperazin-1-yl)phenyl] 2-(4-chloro-3-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-3-methylphenoxy)acetic acid [4-(4-acetyl-1-piperazinyl)phenyl] ester IUPAC Name: [4-(4-acetylpiperazin-1-yl)phenyl] 2-(4-chloro-3-methylphenoxy)acetate Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid [4-(4-acetylpiperazino)phenyl] ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OC2=CC=C(C=C2)N3CCN(CC3)C(=O)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OC2=CC=C(C=C2)N3CCN(CC3)C(=O)C)Cl

InChI

InChI=1S/C21H23ClN2O4/c1-15-13-19(7-8-20(15)22)27-14-21(26)28-18-5-3-17(4-6-18)24-11-9-23(10-12-24)16(2)25/h3-8,13H,9-12,14H2,1-2H3