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

Systemtic Name: 1-[4-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-3-nitro-phenyl]sulfonylpiperidine Openeye Name: 1-[4-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-3-nitro-phenyl]sulfonylpiperidine CAS Name: 1-[4-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-3-nitrophenyl]sulfonylpiperidine IUPAC Name: 1-[4-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-3-nitrophenyl]sulfonylpiperidine Traditional Name: 1-[4-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-3-nitro-phenyl]sulfonylpiperidine Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-])OC

Isomeric SMILES

C/C=C/C1=CC(=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H24N2O6S/c1-3-7-16-8-10-20(21(14-16)28-2)29-19-11-9-17(15-18(19)23(24)25)30(26,27)22-12-5-4-6-13-22/h3,7-11,14-15H,4-6,12-13H2,1-2H3/b7-3+