(4-nitrophenyl) (E)-3-[3-[3-(dimethylamino)propoxy]-4-methoxy-phenyl]prop-2-enoate

Systemtic Name: (4-nitrophenyl) (E)-3-[3-[3-(dimethylamino)propoxy]-4-methoxy-phenyl]prop-2-enoate Openeye Name: (4-nitrophenyl) (E)-3-[3-[3-(dimethylamino)propoxy]-4-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[3-[3-(dimethylamino)propoxy]-4-methoxyphenyl]-2-propenoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (E)-3-[3-[3-(dimethylamino)propoxy]-4-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[3-[3-(dimethylamino)propoxy]-4-methoxy-phenyl]acrylic acid (4-nitrophenyl) ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=C(C=CC(=C1)C=CC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CN(C)CCCOC1=C(C=CC(=C1)/C=C/C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C21H24N2O6/c1-22(2)13-4-14-28-20-15-16(5-11-19(20)27-3)6-12-21(24)29-18-9-7-17(8-10-18)23(25)26/h5-12,15H,4,13-14H2,1-3H3/b12-6+