(2R)-1-[2-hydroxyethyl-(phenylmethyl)amino]-3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propan-2-ol

Systemtic Name: (2R)-1-[2-hydroxyethyl-(phenylmethyl)amino]-3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propan-2-ol Openeye Name: (2R)-1-[benzyl(2-hydroxyethyl)amino]-3-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propan-2-ol CAS Name: (2R)-1-[2-hydroxyethyl-(phenylmethyl)amino]-3-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]-2-propanol IUPAC Name: (2R)-1-[benzyl(2-hydroxyethyl)amino]-3-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)propan-2-ol Traditional Name: (2R)-1-[benzyl(2-hydroxyethyl)amino]-3-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)propan-2-ol Formula: C22H29N3O7S MolecularWeight: 479.54656

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(CN(CCO)CC3=CC=CC=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC[C@@H](CN(CCO)CC3=CC=CC=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C22H29N3O7S/c26-13-12-23(15-18-6-2-1-3-7-18)16-19(27)17-32-22-9-8-20(14-21(22)25(28)29)33(30,31)24-10-4-5-11-24/h1-3,6-9,14,19,26-27H,4-5,10-13,15-17H2/t19-/m1/s1