methyl (2R)-3-methyl-2-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]butanoate

Systemtic Name: methyl (2R)-3-methyl-2-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]butanoate Openeye Name: methyl (2R)-3-methyl-2-[[4-methyl-3-(1-piperidylsulfonyl)benzoyl]amino]butanoate CAS Name: (2R)-3-methyl-2-[[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2R)-3-methyl-2-[(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)amino]butanoate Traditional Name: (2R)-3-methyl-2-[(4-methyl-3-piperidinosulfonyl-benzoyl)amino]butyric acid methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(C(C)C)C(=O)OC)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@H](C(C)C)C(=O)OC)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C19H28N2O5S/c1-13(2)17(19(23)26-4)20-18(22)15-9-8-14(3)16(12-15)27(24,25)21-10-6-5-7-11-21/h8-9,12-13,17H,5-7,10-11H2,1-4H3,(H,20,22)/t17-/m1/s1