(2R)-1-[ethyl(2-methylprop-2-enyl)amino]-3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propan-2-ol

Systemtic Name: (2R)-1-[ethyl(2-methylprop-2-enyl)amino]-3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propan-2-ol Openeye Name: (2R)-1-[ethyl(2-methylallyl)amino]-3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propan-2-ol CAS Name: (2R)-1-[ethyl(2-methylprop-2-enyl)amino]-3-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]-2-propanol IUPAC Name: (2R)-1-[ethyl(2-methylprop-2-enyl)amino]-3-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)propan-2-ol Traditional Name: (2R)-1-[ethyl(2-methylallyl)amino]-3-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)propan-2-ol Formula: C19H29N3O6S MolecularWeight: 427.51506

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])O)CC(=C)C

Isomeric SMILES

CCN(C[C@H](COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])O)CC(=C)C

InChI

InChI=1S/C19H29N3O6S/c1-4-20(12-15(2)3)13-16(23)14-28-19-8-7-17(11-18(19)22(24)25)29(26,27)21-9-5-6-10-21/h7-8,11,16,23H,2,4-6,9-10,12-14H2,1,3H3/t16-/m1/s1