methyl 4-[(4-butan-2-ylphenyl)sulfonylamino]-3-methyl-benzoate

Systemtic Name: methyl 4-[(4-butan-2-ylphenyl)sulfonylamino]-3-methyl-benzoate Openeye Name: methyl 3-methyl-4-[(4-sec-butylphenyl)sulfonylamino]benzoate CAS Name: 4-[(4-butan-2-ylphenyl)sulfonylamino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[(4-butan-2-ylphenyl)sulfonylamino]-3-methylbenzoate Traditional Name: 3-methyl-4-[(4-sec-butylphenyl)sulfonylamino]benzoic acid methyl ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C(=O)OC)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C19H23NO4S/c1-5-13(2)15-6-9-17(10-7-15)25(22,23)20-18-11-8-16(12-14(18)3)19(21)24-4/h6-13,20H,5H2,1-4H3