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

Systemtic Name: 1-[3-nitro-4-[(4-propan-2-ylphenyl)methoxy]phenyl]sulfonylpyrrolidine Openeye Name: 1-[4-[(4-isopropylphenyl)methoxy]-3-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[3-nitro-4-[(4-propan-2-ylphenyl)methoxy]phenyl]sulfonylpyrrolidine IUPAC Name: 1-[3-nitro-4-[(4-propan-2-ylphenyl)methoxy]phenyl]sulfonylpyrrolidine Traditional Name: 1-[4-(4-isopropylbenzyl)oxy-3-nitro-phenyl]sulfonylpyrrolidine Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O5S/c1-15(2)17-7-5-16(6-8-17)14-27-20-10-9-18(13-19(20)22(23)24)28(25,26)21-11-3-4-12-21/h5-10,13,15H,3-4,11-12,14H2,1-2H3