6-tert-butyl-2-(2-chloranylethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: 6-tert-butyl-2-(2-chloranylethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: 6-tert-butyl-2-[(2-chloroacetyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: 6-tert-butyl-2-[(2-chloro-1-oxoethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 6-tert-butyl-2-[(2-chloroacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: 6-tert-butyl-2-[(2-chloroacetyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C15H20ClNO3S MolecularWeight: 329.8422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)O)NC(=O)CCl

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)O)NC(=O)CCl

InChI

InChI=1S/C15H20ClNO3S/c1-15(2,3)8-4-5-9-10(6-8)21-13(12(9)14(19)20)17-11(18)7-16/h8H,4-7H2,1-3H3,(H,17,18)(H,19,20)