N-[(1R)-1-(1-adamantyl)ethyl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C24H33N3O6S MolecularWeight: 491.60032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)COC4=C(C=C(C=C4)S(=O)(=O)N5CCCC5)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)COC4=C(C=C(C=C4)S(=O)(=O)N5CCCC5)[N+](=O)[O-]

InChI

InChI=1S/C24H33N3O6S/c1-16(24-12-17-8-18(13-24)10-19(9-17)14-24)25-23(28)15-33-22-5-4-20(11-21(22)27(29)30)34(31,32)26-6-2-3-7-26/h4-5,11,16-19H,2-3,6-10,12-15H2,1H3,(H,25,28)/t16-,17?,18?,19?,24?/m1/s1