N-[2-[3-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-2-oxidanyl-propoxy]-4-methyl-phenyl]ethanamide

Systemtic Name: N-[2-[3-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-2-oxidanyl-propoxy]-4-methyl-phenyl]ethanamide Openeye Name: N-[2-[3-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-hydroxy-propoxy]-4-methyl-phenyl]acetamide CAS Name: N-[2-[3-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-2-hydroxypropoxy]-4-methylphenyl]acetamide IUPAC Name: N-[2-[3-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-hydroxypropoxy]-4-methylphenyl]acetamide Traditional Name: N-[2-[3-[4-(4-chlorobenzoyl)piperazino]-2-hydroxy-propoxy]-4-methyl-phenyl]acetamide Formula: C23H28ClN3O4 MolecularWeight: 445.93912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C)OCC(CN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C)OCC(CN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C23H28ClN3O4/c1-16-3-8-21(25-17(2)28)22(13-16)31-15-20(29)14-26-9-11-27(12-10-26)23(30)18-4-6-19(24)7-5-18/h3-8,13,20,29H,9-12,14-15H2,1-2H3,(H,25,28)