7-[(4-methanoylphenyl)methyl-methylsulfonyl-amino]heptanoic acid

Systemtic Name: 7-[(4-methanoylphenyl)methyl-methylsulfonyl-amino]heptanoic acid Openeye Name: 7-[(4-formylphenyl)methyl-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[(4-formylphenyl)methyl-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[(4-formylphenyl)methyl-methylsulfonylamino]heptanoic acid Traditional Name: 7-[(4-formylbenzyl)-mesyl-amino]enanthic acid Formula: C16H23NO5S MolecularWeight: 341.42252

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCCCC(=O)O)CC1=CC=C(C=C1)C=O

Isomeric SMILES

CS(=O)(=O)N(CCCCCCC(=O)O)CC1=CC=C(C=C1)C=O

InChI

InChI=1S/C16H23NO5S/c1-23(21,22)17(11-5-3-2-4-6-16(19)20)12-14-7-9-15(13-18)10-8-14/h7-10,13H,2-6,11-12H2,1H3,(H,19,20)