3-phenyl-4-[(2,3,4-trimethylphenyl)sulfonylamino]butanoate

Systemtic Name: 3-phenyl-4-[(2,3,4-trimethylphenyl)sulfonylamino]butanoate Openeye Name: 3-phenyl-4-[(2,3,4-trimethylphenyl)sulfonylamino]butanoate CAS Name: 3-phenyl-4-[(2,3,4-trimethylphenyl)sulfonylamino]butanoate IUPAC Name: 3-phenyl-4-[(2,3,4-trimethylphenyl)sulfonylamino]butanoate Traditional Name: 3-phenyl-4-[(2,3,4-trimethylphenyl)sulfonylamino]butyrate Formula: C19H22NO4S- MolecularWeight: 360.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)NCC(CC(=O)[O-])C2=CC=CC=C2)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)NCC(CC(=O)[O-])C2=CC=CC=C2)C)C

InChI

InChI=1S/C19H23NO4S/c1-13-9-10-18(15(3)14(13)2)25(23,24)20-12-17(11-19(21)22)16-7-5-4-6-8-16/h4-10,17,20H,11-12H2,1-3H3,(H,21,22)/p-1