2-[4-[[(4-methylphenyl)sulfonylamino]methyl]-3,4-dihydro-2H-chromen-7-yl]ethanoic acid

Systemtic Name: 2-[4-[[(4-methylphenyl)sulfonylamino]methyl]-3,4-dihydro-2H-chromen-7-yl]ethanoic acid Openeye Name: 2-[4-[(p-tolylsulfonylamino)methyl]chroman-7-yl]acetic acid CAS Name: 2-[4-[[(4-methylphenyl)sulfonylamino]methyl]-3,4-dihydro-2H-1-benzopyran-7-yl]acetic acid IUPAC Name: 2-[4-[[(4-methylphenyl)sulfonylamino]methyl]-3,4-dihydro-2H-chromen-7-yl]acetic acid Traditional Name: 2-[4-[(tosylamino)methyl]chroman-7-yl]acetic acid Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCOC3=C2C=CC(=C3)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCOC3=C2C=CC(=C3)CC(=O)O

InChI

InChI=1S/C19H21NO5S/c1-13-2-5-16(6-3-13)26(23,24)20-12-15-8-9-25-18-10-14(11-19(21)22)4-7-17(15)18/h2-7,10,15,20H,8-9,11-12H2,1H3,(H,21,22)