(2R)-2-[[2-(2-methoxy-2-oxidanylidene-ethyl)naphthalen-1-yl]sulfonylamino]-3-sulfino-propanoic acid

Systemtic Name: (2R)-2-[[2-(2-methoxy-2-oxidanylidene-ethyl)naphthalen-1-yl]sulfonylamino]-3-sulfino-propanoic acid Openeye Name: (2R)-2-[[2-(2-methoxy-2-oxo-ethyl)-1-naphthyl]sulfonylamino]-3-sulfino-propanoic acid CAS Name: (2R)-2-[[2-(2-methoxy-2-oxoethyl)-1-naphthalenyl]sulfonylamino]-3-sulfinopropanoic acid IUPAC Name: (2R)-2-[[2-(2-methoxy-2-oxoethyl)naphthalen-1-yl]sulfonylamino]-3-sulfinopropanoic acid Traditional Name: (2R)-2-[[2-(2-keto-2-methoxy-ethyl)-1-naphthyl]sulfonylamino]-3-sulfino-propionic acid Formula: C16H17NO8S2 MolecularWeight: 415.43808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)NC(CS(=O)O)C(=O)O

Isomeric SMILES

COC(=O)CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)N[C@@H](CS(=O)O)C(=O)O

InChI

InChI=1S/C16H17NO8S2/c1-25-14(18)8-11-7-6-10-4-2-3-5-12(10)15(11)27(23,24)17-13(16(19)20)9-26(21)22/h2-7,13,17H,8-9H2,1H3,(H,19,20)(H,21,22)/t13-/m0/s1