(2-methyl-5-propan-2-yl-phenyl) 3-[ethyl-(phenylmethyl)sulfamoyl]-4-methoxy-benzoate

Systemtic Name: (2-methyl-5-propan-2-yl-phenyl) 3-[ethyl-(phenylmethyl)sulfamoyl]-4-methoxy-benzoate Openeye Name: (5-isopropyl-2-methyl-phenyl) 3-[benzyl(ethyl)sulfamoyl]-4-methoxy-benzoate CAS Name: 3-[ethyl-(phenylmethyl)sulfamoyl]-4-methoxybenzoic acid (2-methyl-5-propan-2-ylphenyl) ester IUPAC Name: (2-methyl-5-propan-2-ylphenyl) 3-[benzyl(ethyl)sulfamoyl]-4-methoxybenzoate Traditional Name: 3-[benzyl(ethyl)sulfamoyl]-4-methoxy-benzoic acid (5-isopropyl-2-methyl-phenyl) ester Formula: C27H31NO5S MolecularWeight: 481.60374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=C(C=CC(=C3)C(C)C)C)OC

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=C(C=CC(=C3)C(C)C)C)OC

InChI

InChI=1S/C27H31NO5S/c1-6-28(18-21-10-8-7-9-11-21)34(30,31)26-17-23(14-15-24(26)32-5)27(29)33-25-16-22(19(2)3)13-12-20(25)4/h7-17,19H,6,18H2,1-5H3