2,6-dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide; 4-(dipropylamino)-3,5-dinitro-benzenesulfonamide

Systemtic Name: 2,6-dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide; 4-(dipropylamino)-3,5-dinitro-benzenesulfonamide Openeye Name: 4-(dipropylamino)-3,5-dinitro-benzenesulfonamide; N-[3-(1-ethyl-1-methyl-propyl)isoxazol-5-yl]-2,6-dimethoxy-benzamide CAS Name: 2,6-dimethoxy-N-[3-(3-methylpentan-3-yl)-5-isoxazolyl]benzamide; 4-(dipropylamino)-3,5-dinitrobenzenesulfonamide IUPAC Name: 2,6-dimethoxy-N-[3-(3-methylpentan-3-yl)-1,2-oxazol-5-yl]benzamide; 4-(dipropylamino)-3,5-dinitrobenzenesulfonamide Traditional Name: 4-(dipropylamino)-3,5-dinitro-benzenesulfonamide; N-[3-(1-ethyl-1-methyl-propyl)isoxazol-5-yl]-2,6-dimethoxy-benzamide Formula: C30H42N6O10S MolecularWeight: 678.75368

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N)[N+](=O)[O-].CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N)[N+](=O)[O-].CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C18H24N2O4.C12H18N4O6S/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5;1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h8-11H,6-7H2,1-5H3,(H,19,21);7-8H,3-6H2,1-2H3,(H2,13,21,22)