2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-hexyl-amino]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-hexyl-amino]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[(4-chloro-3-nitro-phenyl)sulfonyl-hexyl-amino]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonyl-hexylamino]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[(4-chloro-3-nitrophenyl)sulfonyl-hexylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[(4-chloro-3-nitro-phenyl)sulfonyl-hexyl-amino]-N-(5-methylisoxazol-3-yl)acetamide Formula: C18H23ClN4O6S MolecularWeight: 458.91642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CC(=O)NC1=NOC(=C1)C)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCCN(CC(=O)NC1=NOC(=C1)C)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H23ClN4O6S/c1-3-4-5-6-9-22(12-18(24)20-17-10-13(2)29-21-17)30(27,28)14-7-8-15(19)16(11-14)23(25)26/h7-8,10-11H,3-6,9,12H2,1-2H3,(H,20,21,24)