N-(4-methylcyclohexyl)-3-nitro-4-[[(2R)-oxolan-2-yl]methylamino]benzenesulfonamide

Systemtic Name: N-(4-methylcyclohexyl)-3-nitro-4-[[(2R)-oxolan-2-yl]methylamino]benzenesulfonamide Openeye Name: N-(4-methylcyclohexyl)-3-nitro-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]benzenesulfonamide CAS Name: N-(4-methylcyclohexyl)-3-nitro-4-[[(2R)-2-oxolanyl]methylamino]benzenesulfonamide IUPAC Name: N-(4-methylcyclohexyl)-3-nitro-4-[[(2R)-oxolan-2-yl]methylamino]benzenesulfonamide Traditional Name: N-(4-methylcyclohexyl)-3-nitro-4-[[(2R)-tetrahydrofuran-2-yl]methylamino]benzenesulfonamide Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCC3CCCO3)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NC[C@H]3CCCO3)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O5S/c1-13-4-6-14(7-5-13)20-27(24,25)16-8-9-17(18(11-16)21(22)23)19-12-15-3-2-10-26-15/h8-9,11,13-15,19-20H,2-7,10,12H2,1H3/t13?,14?,15-/m1/s1