methyl 2-methoxy-5-[[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]methyl]benzoate Openeye Name: methyl 2-methoxy-5-[[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]methyl]benzoate CAS Name: 2-methoxy-5-[[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]methyl]benzoate Traditional Name: 2-methoxy-5-[[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]methyl]benzoic acid methyl ester Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCC2=CC(=C(C=C2)OC)C(=O)OC)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCC2=CC(=C(C=C2)OC)C(=O)OC)C)C

InChI

InChI=1S/C21H27NO5S/c1-12-13(2)15(4)20(16(5)14(12)3)28(24,25)22-11-17-8-9-19(26-6)18(10-17)21(23)27-7/h8-10,22H,11H2,1-7H3