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

Systemtic Name: 2-[4-[2-[(3-butyl-7-propan-2-yl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(3-butyl-7-isopropyl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[(3-butyl-7-propan-2-yl-1-azulenyl)sulfonylamino]ethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(3-butyl-7-propan-2-ylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(3-butyl-7-isopropyl-azulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid Formula: C27H33NO5S MolecularWeight: 483.61962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C=CC=C(C=C2C(=C1)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)O)C(C)C

Isomeric SMILES

CCCCC1=C2C=CC=C(C=C2C(=C1)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)O)C(C)C

InChI

InChI=1S/C27H33NO5S/c1-4-5-7-22-17-26(25-16-21(19(2)3)8-6-9-24(22)25)34(31,32)28-15-14-20-10-12-23(13-11-20)33-18-27(29)30/h6,8-13,16-17,19,28H,4-5,7,14-15,18H2,1-3H3,(H,29,30)