methyl 4-[4-[(3,4-dimethylphenyl)sulfonylamino]butanoylamino]benzoate

Systemtic Name: methyl 4-[4-[(3,4-dimethylphenyl)sulfonylamino]butanoylamino]benzoate Openeye Name: methyl 4-[4-[(3,4-dimethylphenyl)sulfonylamino]butanoylamino]benzoate CAS Name: 4-[[4-[(3,4-dimethylphenyl)sulfonylamino]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[(3,4-dimethylphenyl)sulfonylamino]butanoylamino]benzoate Traditional Name: 4-[4-[(3,4-dimethylphenyl)sulfonylamino]butanoylamino]benzoic acid methyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)NC2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)NC2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C20H24N2O5S/c1-14-6-11-18(13-15(14)2)28(25,26)21-12-4-5-19(23)22-17-9-7-16(8-10-17)20(24)27-3/h6-11,13,21H,4-5,12H2,1-3H3,(H,22,23)