methyl 2-[4-(2-acetamido-3-methyl-butanoyl)piperazin-1-yl]-2-(2-chlorophenyl)ethanoate

Systemtic Name: methyl 2-[4-(2-acetamido-3-methyl-butanoyl)piperazin-1-yl]-2-(2-chlorophenyl)ethanoate Openeye Name: methyl 2-[4-(2-acetamido-3-methyl-butanoyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate CAS Name: 2-[4-(2-acetamido-3-methyl-1-oxobutyl)-1-piperazinyl]-2-(2-chlorophenyl)acetic acid methyl ester IUPAC Name: methyl 2-[4-(2-acetamido-3-methylbutanoyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate Traditional Name: 2-[4-(2-acetamido-3-methyl-butanoyl)piperazino]-2-(2-chlorophenyl)acetic acid methyl ester Formula: C20H28ClN3O4 MolecularWeight: 409.90702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C(C2=CC=CC=C2Cl)C(=O)OC)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C(C2=CC=CC=C2Cl)C(=O)OC)NC(=O)C

InChI

InChI=1S/C20H28ClN3O4/c1-13(2)17(22-14(3)25)19(26)24-11-9-23(10-12-24)18(20(27)28-4)15-7-5-6-8-16(15)21/h5-8,13,17-18H,9-12H2,1-4H3,(H,22,25)