(phenylmethyl) 2-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenoxy]sulfonylbenzoate

Systemtic Name: (phenylmethyl) 2-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenoxy]sulfonylbenzoate Openeye Name: benzyl 2-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenoxy]sulfonylbenzoate CAS Name: 2-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenoxy]sulfonylbenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenoxy]sulfonylbenzoate Traditional Name: 2-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenoxy]sulfonylbenzoic acid benzyl ester Formula: C28H26N2O6S MolecularWeight: 518.58084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2C(=O)OCC3=CC=CC=C3)OCCNC4=CC=NC=C4

Isomeric SMILES

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2C(=O)OCC3=CC=CC=C3)OCCNC4=CC=NC=C4

InChI

InChI=1S/C28H26N2O6S/c1-21-17-24(34-16-15-30-23-11-13-29-14-12-23)19-25(18-21)36-37(32,33)27-10-6-5-9-26(27)28(31)35-20-22-7-3-2-4-8-22/h2-14,17-19H,15-16,20H2,1H3,(H,29,30)