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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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