2-[(4-ethylphenyl)sulfonyl-methyl-amino]benzoate

Systemtic Name: 2-[(4-ethylphenyl)sulfonyl-methyl-amino]benzoate Openeye Name: 2-[(4-ethylphenyl)sulfonyl-methyl-amino]benzoate CAS Name: 2-[(4-ethylphenyl)sulfonyl-methylamino]benzoate IUPAC Name: 2-[(4-ethylphenyl)sulfonyl-methylamino]benzoate Traditional Name: 2-[(4-ethylphenyl)sulfonyl-methyl-amino]benzoate Formula: C16H16NO4S- MolecularWeight: 318.36754

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C16H17NO4S/c1-3-12-8-10-13(11-9-12)22(20,21)17(2)15-7-5-4-6-14(15)16(18)19/h4-11H,3H2,1-2H3,(H,18,19)/p-1