(6R)-2-[(3-methoxyphenyl)carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: (6R)-2-[(3-methoxyphenyl)carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: (6R)-2-[(3-methoxybenzoyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: (6R)-2-[[(3-methoxyphenyl)-oxomethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: (6R)-2-[(3-methoxybenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: (6R)-2-(m-anisoylamino)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)O)NC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

C[C@@H]1CCC2=C(C1)SC(=C2C(=O)O)NC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C18H19NO4S/c1-10-6-7-13-14(8-10)24-17(15(13)18(21)22)19-16(20)11-4-3-5-12(9-11)23-2/h3-5,9-10H,6-8H2,1-2H3,(H,19,20)(H,21,22)/t10-/m1/s1