methyl 2-[[1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-3-yl]amino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-3-yl]amino]-3-methyl-butanoate Openeye Name: methyl 2-[(1,1-dioxo-2,3-dihydrobenzothiophen-3-yl)amino]-3-methyl-butanoate CAS Name: 2-[(1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)amino]-3-methylbutanoate Traditional Name: 2-[(1,1-diketo-2,3-dihydrobenzothiophen-3-yl)amino]-3-methyl-butyric acid methyl ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC1CS(=O)(=O)C2=CC=CC=C12

Isomeric SMILES

CC(C)C(C(=O)OC)NC1CS(=O)(=O)C2=CC=CC=C12

InChI

InChI=1S/C14H19NO4S/c1-9(2)13(14(16)19-3)15-11-8-20(17,18)12-7-5-4-6-10(11)12/h4-7,9,11,13,15H,8H2,1-3H3