[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-hexan-2-yl] 4-methylsulfonylbenzoate

Systemtic Name: [1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-hexan-2-yl] 4-methylsulfonylbenzoate Openeye Name: 1-[(5-methylisoxazol-3-yl)carbamoyl]pentyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [1-[(5-methyl-3-isoxazolyl)amino]-1-oxohexan-2-yl] ester IUPAC Name: [1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxohexan-2-yl] 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid 1-[(5-methylisoxazol-3-yl)carbamoyl]pentyl ester Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=NOC(=C1)C)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCCCC(C(=O)NC1=NOC(=C1)C)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C18H22N2O6S/c1-4-5-6-15(17(21)19-16-11-12(2)26-20-16)25-18(22)13-7-9-14(10-8-13)27(3,23)24/h7-11,15H,4-6H2,1-3H3,(H,19,20,21)