ethyl 4-[2-[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]oxyethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]oxyethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(2S)-3-methyl-2-(p-tolylsulfonylamino)butanoyl]oxyacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutoxy]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]oxyacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(2S)-3-methyl-2-(tosylamino)butanoyl]oxyacetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H31N3O7S MolecularWeight: 469.55174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)COC(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)COC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H31N3O7S/c1-5-30-21(27)24-12-10-23(11-13-24)18(25)14-31-20(26)19(15(2)3)22-32(28,29)17-8-6-16(4)7-9-17/h6-9,15,19,22H,5,10-14H2,1-4H3/t19-/m0/s1