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

Systemtic Name: 2-[4-[(4-methylphenyl)sulfonylamino]-3,4-dihydro-2H-chromen-7-yl]ethanoic acid Openeye Name: 2-[4-(p-tolylsulfonylamino)chroman-7-yl]acetic acid CAS Name: 2-[4-[(4-methylphenyl)sulfonylamino]-3,4-dihydro-2H-1-benzopyran-7-yl]acetic acid IUPAC Name: 2-[4-[(4-methylphenyl)sulfonylamino]-3,4-dihydro-2H-chromen-7-yl]acetic acid Traditional Name: 2-[4-(tosylamino)chroman-7-yl]acetic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2CCOC3=C2C=CC(=C3)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2CCOC3=C2C=CC(=C3)CC(=O)O

InChI

InChI=1S/C18H19NO5S/c1-12-2-5-14(6-3-12)25(22,23)19-16-8-9-24-17-10-13(11-18(20)21)4-7-15(16)17/h2-7,10,16,19H,8-9,11H2,1H3,(H,20,21)