5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylic acid Openeye Name: 5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylic acid CAS Name: 5-methyl-2-[(1-oxo-4-phenoxybutyl)amino]-3-thiophenecarboxylic acid IUPAC Name: 5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylic acid Traditional Name: 5-methyl-2-(4-phenoxybutanoylamino)-3-thenoic acid Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)CCCOC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)CCCOC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H17NO4S/c1-11-10-13(16(19)20)15(22-11)17-14(18)8-5-9-21-12-6-3-2-4-7-12/h2-4,6-7,10H,5,8-9H2,1H3,(H,17,18)(H,19,20)