N-[5-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[5-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[5-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: N-[5-chloro-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]-3-phenylmethoxybenzamide IUPAC Name: N-[5-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[5-chloro-2-(4-isobutyrylpiperazino)phenyl]benzamide Formula: C28H30ClN3O3 MolecularWeight: 492.0091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H30ClN3O3/c1-20(2)28(34)32-15-13-31(14-16-32)26-12-11-23(29)18-25(26)30-27(33)22-9-6-10-24(17-22)35-19-21-7-4-3-5-8-21/h3-12,17-18,20H,13-16,19H2,1-2H3,(H,30,33)