4-methoxy-2-[1-(4-methylphenyl)sulfonylbutyl]-1-nitro-benzene

Systemtic Name: 4-methoxy-2-[1-(4-methylphenyl)sulfonylbutyl]-1-nitro-benzene Openeye Name: 4-methoxy-1-nitro-2-[1-(p-tolylsulfonyl)butyl]benzene CAS Name: 4-methoxy-2-[1-(4-methylphenyl)sulfonylbutyl]-1-nitrobenzene IUPAC Name: 4-methoxy-2-[1-(4-methylphenyl)sulfonylbutyl]-1-nitrobenzene Traditional Name: 4-methoxy-1-nitro-2-(1-tosylbutyl)benzene Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=CC(=C1)OC)[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(C1=C(C=CC(=C1)OC)[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H21NO5S/c1-4-5-18(25(22,23)15-9-6-13(2)7-10-15)16-12-14(24-3)8-11-17(16)19(20)21/h6-12,18H,4-5H2,1-3H3