2-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]-3-hydroxy-propanoic acid CAS Name: 2-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-3-hydroxypropanoic acid IUPAC Name: 2-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-3-hydroxypropanoic acid Traditional Name: 2-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]-3-hydroxy-propionic acid Formula: C10H11ClN2O7S MolecularWeight: 338.72154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC(CO)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC(CO)C(=O)O)Cl

InChI

InChI=1S/C10H11ClN2O7S/c1-5-7(11)2-6(3-9(5)13(17)18)21(19,20)12-8(4-14)10(15)16/h2-3,8,12,14H,4H2,1H3,(H,15,16)