methyl 4-methyl-2-[2-[(2-nitrophenyl)methylsulfonylamino]ethanoylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[2-[(2-nitrophenyl)methylsulfonylamino]ethanoylamino]pentanoate Openeye Name: methyl 4-methyl-2-[[2-[(2-nitrophenyl)methylsulfonylamino]acetyl]amino]pentanoate CAS Name: 4-methyl-2-[[2-[(2-nitrophenyl)methylsulfonylamino]-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-[(2-nitrophenyl)methylsulfonylamino]acetyl]amino]pentanoate Traditional Name: 4-methyl-2-[[2-[(2-nitrobenzyl)sulfonylamino]acetyl]amino]valeric acid methyl ester Formula: C16H23N3O7S MolecularWeight: 401.43472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CNS(=O)(=O)CC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CNS(=O)(=O)CC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O7S/c1-11(2)8-13(16(21)26-3)18-15(20)9-17-27(24,25)10-12-6-4-5-7-14(12)19(22)23/h4-7,11,13,17H,8-10H2,1-3H3,(H,18,20)