N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-2-(3,4-dimethylphenoxy)ethanamide

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-2-(3,4-dimethylphenoxy)ethanamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]-2-(3,4-dimethylphenoxy)acetamide CAS Name: N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-2-(3,4-dimethylphenoxy)acetamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-2-(3,4-dimethylphenoxy)acetamide Traditional Name: N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]-2-(3,4-dimethylphenoxy)acetamide Formula: C24H30ClN3O3 MolecularWeight: 443.9663

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)COC3=CC(=C(C=C3)C)C)Cl

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)COC3=CC(=C(C=C3)C)C)Cl

InChI

InChI=1S/C24H30ClN3O3/c1-4-5-24(30)28-12-10-27(11-13-28)22-9-7-19(15-21(22)25)26-23(29)16-31-20-8-6-17(2)18(3)14-20/h6-9,14-15H,4-5,10-13,16H2,1-3H3,(H,26,29)