2-acetamido-2-azanyl-6-methoxy-3-(phenylsulfonyl)hex-4-ynoic acid

Systemtic Name: 2-acetamido-2-azanyl-6-methoxy-3-(phenylsulfonyl)hex-4-ynoic acid Openeye Name: 2-acetamido-2-amino-3-(benzenesulfonyl)-6-methoxy-hex-4-ynoic acid CAS Name: 2-acetamido-2-amino-3-(benzenesulfonyl)-6-methoxy-4-hexynoic acid IUPAC Name: 2-acetamido-2-amino-3-(benzenesulfonyl)-6-methoxyhex-4-ynoic acid Traditional Name: 2-acetamido-2-amino-3-besyl-6-methoxy-hex-4-ynoic acid Formula: C15H18N2O6S MolecularWeight: 354.37822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(C#CCOC)S(=O)(=O)C1=CC=CC=C1)(C(=O)O)N

Isomeric SMILES

CC(=O)NC(C(C#CCOC)S(=O)(=O)C1=CC=CC=C1)(C(=O)O)N

InChI

InChI=1S/C15H18N2O6S/c1-11(18)17-15(16,14(19)20)13(9-6-10-23-2)24(21,22)12-7-4-3-5-8-12/h3-5,7-8,13H,10,16H2,1-2H3,(H,17,18)(H,19,20)