(2R)-4-methyl-2-[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]pentanoate

Systemtic Name: (2R)-4-methyl-2-[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]pentanoate Openeye Name: (2R)-4-methyl-2-(4-morpholinosulfonyl-2-nitro-anilino)pentanoate CAS Name: (2R)-4-methyl-2-[4-(4-morpholinylsulfonyl)-2-nitroanilino]pentanoate IUPAC Name: (2R)-4-methyl-2-(4-morpholin-4-ylsulfonyl-2-nitroanilino)pentanoate Traditional Name: (2R)-4-methyl-2-(4-morpholinosulfonyl-2-nitro-anilino)valerate Formula: C16H22N3O7S- MolecularWeight: 400.42678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C[C@H](C(=O)[O-])NC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O7S/c1-11(2)9-14(16(20)21)17-13-4-3-12(10-15(13)19(22)23)27(24,25)18-5-7-26-8-6-18/h3-4,10-11,14,17H,5-9H2,1-2H3,(H,20,21)/p-1/t14-/m1/s1