2-[4-[2-[(3-methyl-7-propan-2-yl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(3-methyl-7-propan-2-yl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(7-isopropyl-3-methyl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[(3-methyl-7-propan-2-yl-1-azulenyl)sulfonylamino]ethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(3-methyl-7-propan-2-ylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(7-isopropyl-3-methyl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid Formula: C24H27NO5S MolecularWeight: 441.53988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=C(C=C2C(=C1)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)O)C(C)C

Isomeric SMILES

CC1=C2C=CC=C(C=C2C(=C1)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)O)C(C)C

InChI

InChI=1S/C24H27NO5S/c1-16(2)19-5-4-6-21-17(3)13-23(22(21)14-19)31(28,29)25-12-11-18-7-9-20(10-8-18)30-15-24(26)27/h4-10,13-14,16,25H,11-12,15H2,1-3H3,(H,26,27)