methyl 4-[[methyl-(3-methyl-4-propan-2-yloxy-phenyl)sulfonyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-(3-methyl-4-propan-2-yloxy-phenyl)sulfonyl-amino]methyl]benzoate Openeye Name: methyl 4-[[(4-isopropoxy-3-methyl-phenyl)sulfonyl-methyl-amino]methyl]benzoate CAS Name: 4-[[methyl-(3-methyl-4-propan-2-yloxyphenyl)sulfonylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[methyl-(3-methyl-4-propan-2-yloxyphenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[[(4-isopropoxy-3-methyl-phenyl)sulfonyl-methyl-amino]methyl]benzoic acid methyl ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)C(=O)OC)OC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)C(=O)OC)OC(C)C

InChI

InChI=1S/C20H25NO5S/c1-14(2)26-19-11-10-18(12-15(19)3)27(23,24)21(4)13-16-6-8-17(9-7-16)20(22)25-5/h6-12,14H,13H2,1-5H3