1-[4-(2-methoxy-4-prop-2-enyl-phenoxy)-3-nitro-phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[4-(2-methoxy-4-prop-2-enyl-phenoxy)-3-nitro-phenyl]sulfonylpyrrolidine Openeye Name: 1-[4-(4-allyl-2-methoxy-phenoxy)-3-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[4-(2-methoxy-4-prop-2-enylphenoxy)-3-nitrophenyl]sulfonylpyrrolidine IUPAC Name: 1-[4-(2-methoxy-4-prop-2-enylphenoxy)-3-nitrophenyl]sulfonylpyrrolidine Traditional Name: 1-[4-(4-allyl-2-methoxy-phenoxy)-3-nitro-phenyl]sulfonylpyrrolidine Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6S/c1-3-6-15-7-9-19(20(13-15)27-2)28-18-10-8-16(14-17(18)22(23)24)29(25,26)21-11-4-5-12-21/h3,7-10,13-14H,1,4-6,11-12H2,2H3