N-[3-chloranyl-4-(4-propanoylpiperazin-1-yl)phenyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-propanoylpiperazin-1-yl)phenyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]benzamide CAS Name: N-[3-chloro-4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-3-phenylmethoxybenzamide IUPAC Name: N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[3-chloro-4-(4-propionylpiperazino)phenyl]benzamide Formula: C27H28ClN3O3 MolecularWeight: 477.98252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28ClN3O3/c1-2-26(32)31-15-13-30(14-16-31)25-12-11-22(18-24(25)28)29-27(33)21-9-6-10-23(17-21)34-19-20-7-4-3-5-8-20/h3-12,17-18H,2,13-16,19H2,1H3,(H,29,33)