1-[3-nitro-4-(4-propan-2-ylphenoxy)phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[3-nitro-4-(4-propan-2-ylphenoxy)phenyl]sulfonylpyrrolidine Openeye Name: 1-[4-(4-isopropylphenoxy)-3-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[3-nitro-4-(4-propan-2-ylphenoxy)phenyl]sulfonylpyrrolidine IUPAC Name: 1-[3-nitro-4-(4-propan-2-ylphenoxy)phenyl]sulfonylpyrrolidine Traditional Name: 1-[4-(4-isopropylphenoxy)-3-nitro-phenyl]sulfonylpyrrolidine Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O5S/c1-14(2)15-5-7-16(8-6-15)26-19-10-9-17(13-18(19)21(22)23)27(24,25)20-11-3-4-12-20/h5-10,13-14H,3-4,11-12H2,1-2H3