methyl 2-acetamido-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-acetamido-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-acetamido-6-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-acetamido-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-6-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=C(S1)CC(CC2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(=O)NC1=C(C2=C(S1)CC(CC2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C18H19NO3S/c1-11(20)19-17-16(18(21)22-2)14-9-8-13(10-15(14)23-17)12-6-4-3-5-7-12/h3-7,13H,8-10H2,1-2H3,(H,19,20)