methyl 2-azanyl-3-[(6-chloranyl-3-oxidanylidene-1,2-dihydroinden-2-yl)sulfonyl]propanoate

Systemtic Name: methyl 2-azanyl-3-[(6-chloranyl-3-oxidanylidene-1,2-dihydroinden-2-yl)sulfonyl]propanoate Openeye Name: methyl 2-amino-3-(5-chloro-1-oxo-indan-2-yl)sulfonyl-propanoate CAS Name: 2-amino-3-[(6-chloro-3-oxo-1,2-dihydroinden-2-yl)sulfonyl]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[(6-chloro-3-oxo-1,2-dihydroinden-2-yl)sulfonyl]propanoate Traditional Name: 2-amino-3-(5-chloro-1-keto-indan-2-yl)sulfonyl-propionic acid methyl ester Formula: C13H14ClNO5S MolecularWeight: 331.77196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CS(=O)(=O)C1CC2=C(C1=O)C=CC(=C2)Cl)N

Isomeric SMILES

COC(=O)C(CS(=O)(=O)C1CC2=C(C1=O)C=CC(=C2)Cl)N

InChI

InChI=1S/C13H14ClNO5S/c1-20-13(17)10(15)6-21(18,19)11-5-7-4-8(14)2-3-9(7)12(11)16/h2-4,10-11H,5-6,15H2,1H3