ethyl (Z)-4-[4-[4-(fluoranylmethyl)-2-nitro-phenoxy]phenoxy]-3-methoxy-pent-2-enoate

Systemtic Name: ethyl (Z)-4-[4-[4-(fluoranylmethyl)-2-nitro-phenoxy]phenoxy]-3-methoxy-pent-2-enoate Openeye Name: ethyl (Z)-4-[4-[4-(fluoromethyl)-2-nitro-phenoxy]phenoxy]-3-methoxy-pent-2-enoate CAS Name: (Z)-4-[4-[4-(fluoromethyl)-2-nitrophenoxy]phenoxy]-3-methoxy-2-pentenoic acid ethyl ester IUPAC Name: ethyl (Z)-4-[4-[4-(fluoromethyl)-2-nitrophenoxy]phenoxy]-3-methoxypent-2-enoate Traditional Name: (Z)-4-[4-[4-(fluoromethyl)-2-nitro-phenoxy]phenoxy]-3-methoxy-pent-2-enoic acid ethyl ester Formula: C21H22FNO7 MolecularWeight: 419.400283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)CF)[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)/C=C(/C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)CF)[N+](=O)[O-])\OC

InChI

InChI=1S/C21H22FNO7/c1-4-28-21(24)12-20(27-3)14(2)29-16-6-8-17(9-7-16)30-19-10-5-15(13-22)11-18(19)23(25)26/h5-12,14H,4,13H2,1-3H3/b20-12-