2-(4-methylpentanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-(4-methylpentanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: 2-(4-methylpentanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: 2-[(4-methyl-1-oxopentyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-(4-methylpentanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: 2-(4-methylpentanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)O

Isomeric SMILES

CC(C)CCC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)O

InChI

InChI=1S/C15H21NO3S/c1-9(2)7-8-12(17)16-14-13(15(18)19)10-5-3-4-6-11(10)20-14/h9H,3-8H2,1-2H3,(H,16,17)(H,18,19)