N-[2-(3-chloranyl-4-methoxy-phenyl)ethyl]-2-[4-(3-methylbutanoyl)piperazin-2-yl]ethanamide

Systemtic Name: N-[2-(3-chloranyl-4-methoxy-phenyl)ethyl]-2-[4-(3-methylbutanoyl)piperazin-2-yl]ethanamide Openeye Name: N-[2-(3-chloro-4-methoxy-phenyl)ethyl]-2-[4-(3-methylbutanoyl)piperazin-2-yl]acetamide CAS Name: N-[2-(3-chloro-4-methoxyphenyl)ethyl]-2-[4-(3-methyl-1-oxobutyl)-2-piperazinyl]acetamide IUPAC Name: N-[2-(3-chloro-4-methoxyphenyl)ethyl]-2-[4-(3-methylbutanoyl)piperazin-2-yl]acetamide Traditional Name: N-[2-(3-chloro-4-methoxy-phenyl)ethyl]-2-(4-isovalerylpiperazin-2-yl)acetamide Formula: C20H30ClN3O3 MolecularWeight: 395.9235

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCNC(C1)CC(=O)NCCC2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

CC(C)CC(=O)N1CCNC(C1)CC(=O)NCCC2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C20H30ClN3O3/c1-14(2)10-20(26)24-9-8-22-16(13-24)12-19(25)23-7-6-15-4-5-18(27-3)17(21)11-15/h4-5,11,14,16,22H,6-10,12-13H2,1-3H3,(H,23,25)