methyl (2R)-2-[[4-[(4-acetyloxyphenyl)carbonylamino]phenyl]sulfonylamino]-3-methyl-butanoate

Systemtic Name: methyl (2R)-2-[[4-[(4-acetyloxyphenyl)carbonylamino]phenyl]sulfonylamino]-3-methyl-butanoate Openeye Name: methyl (2R)-2-[[4-[(4-acetoxybenzoyl)amino]phenyl]sulfonylamino]-3-methyl-butanoate CAS Name: (2R)-2-[[4-[[(4-acetyloxyphenyl)-oxomethyl]amino]phenyl]sulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[4-[(4-acetyloxybenzoyl)amino]phenyl]sulfonylamino]-3-methylbutanoate Traditional Name: (2R)-2-[[4-[(4-acetoxybenzoyl)amino]phenyl]sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OC(=O)C

Isomeric SMILES

CC(C)[C@H](C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OC(=O)C

InChI

InChI=1S/C21H24N2O7S/c1-13(2)19(21(26)29-4)23-31(27,28)18-11-7-16(8-12-18)22-20(25)15-5-9-17(10-6-15)30-14(3)24/h5-13,19,23H,1-4H3,(H,22,25)/t19-/m1/s1