propyl (6R)-2-(hexanoylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: propyl (6R)-2-(hexanoylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: propyl (6R)-2-(hexanoylamino)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6R)-6-methyl-2-(1-oxohexylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propyl ester IUPAC Name: propyl (6R)-2-(hexanoylamino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6R)-2-(caproylamino)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid propyl ester Formula: C19H29NO3S MolecularWeight: 351.50346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=C(C2=C(S1)CC(CC2)C)C(=O)OCCC

Isomeric SMILES

CCCCCC(=O)NC1=C(C2=C(S1)C[C@@H](CC2)C)C(=O)OCCC

InChI

InChI=1S/C19H29NO3S/c1-4-6-7-8-16(21)20-18-17(19(22)23-11-5-2)14-10-9-13(3)12-15(14)24-18/h13H,4-12H2,1-3H3,(H,20,21)/t13-/m1/s1