methyl (2S)-4-methylsulfonyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoate

Systemtic Name: methyl (2S)-4-methylsulfonyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoate Openeye Name: methyl (2S)-4-methylsulfonyl-2-[(3,4,5-trimethoxybenzoyl)amino]butanoate CAS Name: (2S)-4-methylsulfonyl-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-4-methylsulfonyl-2-[(3,4,5-trimethoxybenzoyl)amino]butanoate Traditional Name: (2S)-4-mesyl-2-[(3,4,5-trimethoxybenzoyl)amino]butyric acid methyl ester Formula: C16H23NO8S MolecularWeight: 389.42072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(CCS(=O)(=O)C)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N[C@@H](CCS(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C16H23NO8S/c1-22-12-8-10(9-13(23-2)14(12)24-3)15(18)17-11(16(19)25-4)6-7-26(5,20)21/h8-9,11H,6-7H2,1-5H3,(H,17,18)/t11-/m0/s1