(4-aminocarbonylphenyl)methyl 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: (4-aminocarbonylphenyl)methyl 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: (4-carbamoylphenyl)methyl 6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid (4-carbamoylbenzyl) ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)OCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC1CCC2=C(C1)SC=C2C(=O)OCC3=CC=C(C=C3)C(=O)N

InChI

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