methyl 4-[4-[1-[(4-nitrophenyl)sulfonylamino]hexyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[1-[(4-nitrophenyl)sulfonylamino]hexyl]phenyl]butanoate Openeye Name: methyl 4-[4-[1-[(4-nitrophenyl)sulfonylamino]hexyl]phenyl]butanoate CAS Name: 4-[4-[1-[(4-nitrophenyl)sulfonylamino]hexyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[1-[(4-nitrophenyl)sulfonylamino]hexyl]phenyl]butanoate Traditional Name: 4-[4-[1-(nosylamino)hexyl]phenyl]butyric acid methyl ester Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)CCCC(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)CCCC(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C23H30N2O6S/c1-3-4-5-8-22(19-12-10-18(11-13-19)7-6-9-23(26)31-2)24-32(29,30)21-16-14-20(15-17-21)25(27)28/h10-17,22,24H,3-9H2,1-2H3