octyl 2-[[5-(2-phenoxyethylsulfonylcarbamoyl)pyridin-2-yl]carbonylamino]ethanoate

Systemtic Name: octyl 2-[[5-(2-phenoxyethylsulfonylcarbamoyl)pyridin-2-yl]carbonylamino]ethanoate Openeye Name: octyl 2-[[5-(2-phenoxyethylsulfonylcarbamoyl)pyridine-2-carbonyl]amino]acetate CAS Name: 2-[[oxo-[5-[oxo-(2-phenoxyethylsulfonylamino)methyl]-2-pyridinyl]methyl]amino]acetic acid octyl ester IUPAC Name: octyl 2-[[5-(2-phenoxyethylsulfonylcarbamoyl)pyridine-2-carbonyl]amino]acetate Traditional Name: 2-[[5-(2-phenoxyethylsulfonylcarbamoyl)picolinoyl]amino]acetic acid octyl ester Formula: C25H33N3O7S MolecularWeight: 519.61042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CNC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)CCOC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCOC(=O)CNC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)CCOC2=CC=CC=C2

InChI

InChI=1S/C25H33N3O7S/c1-2-3-4-5-6-10-15-35-23(29)19-27-25(31)22-14-13-20(18-26-22)24(30)28-36(32,33)17-16-34-21-11-8-7-9-12-21/h7-9,11-14,18H,2-6,10,15-17,19H2,1H3,(H,27,31)(H,28,30)