N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-4-ethyl-benzamide

Systemtic Name: N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-4-ethyl-benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chloro-phenyl]-4-ethyl-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)-3-chlorophenyl]-4-ethylbenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chlorophenyl]-4-ethylbenzamide Traditional Name: N-[4-(4-benzoylpiperazino)-3-chloro-phenyl]-4-ethyl-benzamide Formula: C26H26ClN3O2 MolecularWeight: 447.95654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C26H26ClN3O2/c1-2-19-8-10-20(11-9-19)25(31)28-22-12-13-24(23(27)18-22)29-14-16-30(17-15-29)26(32)21-6-4-3-5-7-21/h3-13,18H,2,14-17H2,1H3,(H,28,31)