methyl (2R)-2-[[(2R)-1-ethanoyl-4-(phenylsulfonyl)piperazin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl (2R)-2-[[(2R)-1-ethanoyl-4-(phenylsulfonyl)piperazin-2-yl]carbonylamino]propanoate Openeye Name: methyl (2R)-2-[[(2R)-1-acetyl-4-(benzenesulfonyl)piperazine-2-carbonyl]amino]propanoate CAS Name: (2R)-2-[[[(2R)-1-acetyl-4-(benzenesulfonyl)-2-piperazinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2R)-1-acetyl-4-(benzenesulfonyl)piperazine-2-carbonyl]amino]propanoate Traditional Name: (2R)-2-[[(2R)-1-acetyl-4-besyl-piperazine-2-carbonyl]amino]propionic acid methyl ester Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C1CN(CCN1C(=O)C)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)OC)NC(=O)[C@H]1CN(CCN1C(=O)C)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H23N3O6S/c1-12(17(23)26-3)18-16(22)15-11-19(9-10-20(15)13(2)21)27(24,25)14-7-5-4-6-8-14/h4-8,12,15H,9-11H2,1-3H3,(H,18,22)/t12-,15-/m1/s1