O8-[(6-chloranylnaphthalen-2-yl)sulfonylamino] O1-methyl 4-oxidanylideneoctanedioate

Systemtic Name: O8-[(6-chloranylnaphthalen-2-yl)sulfonylamino] O1-methyl 4-oxidanylideneoctanedioate Openeye Name: O8-[(6-chloro-2-naphthyl)sulfonylamino] O1-methyl 4-oxooctanedioate CAS Name: 4-oxooctanedioic acid O8-[(6-chloro-2-naphthalenyl)sulfonylamino] ester O1-methyl ester IUPAC Name: 8-O-[(6-chloronaphthalen-2-yl)sulfonylamino] 1-O-methyl 4-oxooctanedioate Traditional Name: 4-ketosuberic acid O8-[(6-chloro-2-naphthyl)sulfonylamino] ester O1-methyl ester Formula: C19H20ClNO7S MolecularWeight: 441.8826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)CCCC(=O)ONS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCC(=O)CCCC(=O)ONS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)Cl

InChI

InChI=1S/C19H20ClNO7S/c1-27-18(23)10-8-16(22)3-2-4-19(24)28-21-29(25,26)17-9-6-13-11-15(20)7-5-14(13)12-17/h5-7,9,11-12,21H,2-4,8,10H2,1H3