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

Systemtic Name: 2-[4-[2-[(3-ethyl-7-propan-2-yl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(3-ethyl-7-isopropyl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[(3-ethyl-7-propan-2-yl-1-azulenyl)sulfonylamino]ethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(3-ethyl-7-propan-2-ylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(3-ethyl-7-isopropyl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid Formula: C25H29NO5S MolecularWeight: 455.56646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC=C(C=C2C(=C1)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)O)C(C)C

Isomeric SMILES

CCC1=C2C=CC=C(C=C2C(=C1)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)O)C(C)C

InChI

InChI=1S/C25H29NO5S/c1-4-19-15-24(23-14-20(17(2)3)6-5-7-22(19)23)32(29,30)26-13-12-18-8-10-21(11-9-18)31-16-25(27)28/h5-11,14-15,17,26H,4,12-13,16H2,1-3H3,(H,27,28)