4-tert-butylcyclohexan-1-amine; N-[2-(4-methoxyphenoxy)-4-nitro-phenyl]methanesulfonamide

Systemtic Name: 4-tert-butylcyclohexan-1-amine; N-[2-(4-methoxyphenoxy)-4-nitro-phenyl]methanesulfonamide Openeye Name: 4-tert-butylcyclohexanamine; N-[2-(4-methoxyphenoxy)-4-nitro-phenyl]methanesulfonamide CAS Name: 4-tert-butyl-1-cyclohexanamine; N-[2-(4-methoxyphenoxy)-4-nitrophenyl]methanesulfonamide IUPAC Name: 4-tert-butylcyclohexan-1-amine; N-[2-(4-methoxyphenoxy)-4-nitrophenyl]methanesulfonamide Traditional Name: (4-tert-butylcyclohexyl)amine; N-[2-(4-methoxyphenoxy)-4-nitro-phenyl]methanesulfonamide Formula: C24H35N3O6S MolecularWeight: 493.6162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)N.COC1=CC=C(C=C1)OC2=C(C=CC(=C2)[N+](=O)[O-])NS(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1CCC(CC1)N.COC1=CC=C(C=C1)OC2=C(C=CC(=C2)[N+](=O)[O-])NS(=O)(=O)C

InChI

InChI=1S/C14H14N2O6S.C10H21N/c1-21-11-4-6-12(7-5-11)22-14-9-10(16(17)18)3-8-13(14)15-23(2,19)20;1-10(2,3)8-4-6-9(11)7-5-8/h3-9,15H,1-2H3;8-9H,4-7,11H2,1-3H3