ethyl 2-methyl-6-(4-nitrophenyl)-3-[phenyl(prop-2-enyl)amino]-4-prop-2-enoxy-benzoate

Systemtic Name: ethyl 2-methyl-6-(4-nitrophenyl)-3-[phenyl(prop-2-enyl)amino]-4-prop-2-enoxy-benzoate Openeye Name: ethyl 3-(N-allylanilino)-4-allyloxy-2-methyl-6-(4-nitrophenyl)benzoate CAS Name: 2-methyl-6-(4-nitrophenyl)-4-prop-2-enoxy-3-(N-prop-2-enylanilino)benzoic acid ethyl ester IUPAC Name: ethyl 2-methyl-6-(4-nitrophenyl)-4-prop-2-enoxy-3-(N-prop-2-enylanilino)benzoate Traditional Name: 3-(N-allylanilino)-4-allyloxy-2-methyl-6-(4-nitrophenyl)benzoic acid ethyl ester Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1C2=CC=C(C=C2)[N+](=O)[O-])OCC=C)N(CC=C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1C2=CC=C(C=C2)[N+](=O)[O-])OCC=C)N(CC=C)C3=CC=CC=C3)C

InChI

InChI=1S/C28H28N2O5/c1-5-17-29(22-11-9-8-10-12-22)27-20(4)26(28(31)34-7-3)24(19-25(27)35-18-6-2)21-13-15-23(16-14-21)30(32)33/h5-6,8-16,19H,1-2,7,17-18H2,3-4H3