methyl 6-[(4-methyl-3-nitro-phenyl)sulfonylamino]hexanoate

Systemtic Name: methyl 6-[(4-methyl-3-nitro-phenyl)sulfonylamino]hexanoate Openeye Name: methyl 6-[(4-methyl-3-nitro-phenyl)sulfonylamino]hexanoate CAS Name: 6-[(4-methyl-3-nitrophenyl)sulfonylamino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(4-methyl-3-nitrophenyl)sulfonylamino]hexanoate Traditional Name: 6-[(4-methyl-3-nitro-phenyl)sulfonylamino]hexanoic acid methyl ester Formula: C14H20N2O6S MolecularWeight: 344.3834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCCCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCCCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H20N2O6S/c1-11-7-8-12(10-13(11)16(18)19)23(20,21)15-9-5-3-4-6-14(17)22-2/h7-8,10,15H,3-6,9H2,1-2H3