methyl 2-[4-[2-[(3-propan-2-ylazulen-1-yl)sulfonylamino]ethyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[2-[(3-propan-2-ylazulen-1-yl)sulfonylamino]ethyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[2-[(3-isopropylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetate CAS Name: 2-[4-[2-[(3-propan-2-yl-1-azulenyl)sulfonylamino]ethyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[2-[(3-propan-2-ylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetate Traditional Name: 2-[4-[2-[(3-isopropylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid methyl ester Formula: C24H27NO5S MolecularWeight: 441.53988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C1=CC=CC=C2)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C2C1=CC=CC=C2)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)OC

InChI

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