2-(2-ethylbutanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Systemtic Name: 2-(2-ethylbutanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Openeye Name: 2-(2-ethylbutanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate CAS Name: 2-[(2-ethyl-1-oxobutyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate IUPAC Name: 2-(2-ethylbutanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Traditional Name: 2-(2-ethylbutanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Formula: C16H22NO3S- MolecularWeight: 308.41578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C2=C(S1)CCCCC2)C(=O)[O-]

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C2=C(S1)CCCCC2)C(=O)[O-]

InChI

InChI=1S/C16H23NO3S/c1-3-10(4-2)14(18)17-15-13(16(19)20)11-8-6-5-7-9-12(11)21-15/h10H,3-9H2,1-2H3,(H,17,18)(H,19,20)/p-1