methyl 2-[(4-fluoranyl-3-methyl-1-benzothiophen-2-yl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(4-fluoranyl-3-methyl-1-benzothiophen-2-yl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[(4-fluoro-3-methyl-benzothiophene-2-carbonyl)amino]-3-hydroxy-propanoate CAS Name: 2-[[(4-fluoro-3-methyl-1-benzothiophen-2-yl)-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[(4-fluoro-3-methyl-1-benzothiophene-2-carbonyl)amino]-3-hydroxypropanoate Traditional Name: 2-[(4-fluoro-3-methyl-benzothiophene-2-carbonyl)amino]-3-hydroxy-propionic acid methyl ester Formula: C14H14FNO4S MolecularWeight: 311.328663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC(CO)C(=O)OC

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC(CO)C(=O)OC

InChI

InChI=1S/C14H14FNO4S/c1-7-11-8(15)4-3-5-10(11)21-12(7)13(18)16-9(6-17)14(19)20-2/h3-5,9,17H,6H2,1-2H3,(H,16,18)