2-methoxy-1-(3-methylbutoxy)-4-[(E)-2-(4-nitrophenyl)sulfonylethenyl]benzene

Systemtic Name: 2-methoxy-1-(3-methylbutoxy)-4-[(E)-2-(4-nitrophenyl)sulfonylethenyl]benzene Openeye Name: 1-isopentyloxy-2-methoxy-4-[(E)-2-(4-nitrophenyl)sulfonylvinyl]benzene CAS Name: 2-methoxy-1-(3-methylbutoxy)-4-[(E)-2-(4-nitrophenyl)sulfonylethenyl]benzene IUPAC Name: 2-methoxy-1-(3-methylbutoxy)-4-[(E)-2-(4-nitrophenyl)sulfonylethenyl]benzene Traditional Name: 1-isoamoxy-2-methoxy-4-[(E)-2-nosylvinyl]benzene Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)/C=C/S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23NO6S/c1-15(2)10-12-27-19-9-4-16(14-20(19)26-3)11-13-28(24,25)18-7-5-17(6-8-18)21(22)23/h4-9,11,13-15H,10,12H2,1-3H3/b13-11+