methyl 4-methyl-3-[[(5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[[(5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[(5R)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]benzoate CAS Name: 4-methyl-3-[[[(5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[(5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]benzoate Traditional Name: 4-methyl-3-[[(5R)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]benzoic acid methyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C

Isomeric SMILES

C[C@@H]1CCC2=C(C1)C=C(S2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C

InChI

InChI=1S/C19H21NO3S/c1-11-4-7-16-14(8-11)10-17(24-16)18(21)20-15-9-13(19(22)23-3)6-5-12(15)2/h5-6,9-11H,4,7-8H2,1-3H3,(H,20,21)/t11-/m1/s1