ethyl (2S)-2-[[4-(ethoxycarbonylamino)phenyl]sulfonylamino]-4-methyl-pentanoate

Systemtic Name: ethyl (2S)-2-[[4-(ethoxycarbonylamino)phenyl]sulfonylamino]-4-methyl-pentanoate Openeye Name: ethyl (2S)-2-[[4-(ethoxycarbonylamino)phenyl]sulfonylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[4-(ethoxycarbonylamino)phenyl]sulfonylamino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[4-(ethoxycarbonylamino)phenyl]sulfonylamino]-4-methylpentanoate Traditional Name: (2S)-2-[[4-(carbethoxyamino)phenyl]sulfonylamino]-4-methyl-valeric acid ethyl ester Formula: C17H26N2O6S MolecularWeight: 386.46314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)OCC

Isomeric SMILES

CCOC(=O)[C@H](CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)OCC

InChI

InChI=1S/C17H26N2O6S/c1-5-24-16(20)15(11-12(3)4)19-26(22,23)14-9-7-13(8-10-14)18-17(21)25-6-2/h7-10,12,15,19H,5-6,11H2,1-4H3,(H,18,21)/t15-/m0/s1