ethyl 6-(1,3-benzodioxol-5-yl)-2-methyl-3-[phenyl(prop-2-enyl)amino]-4-prop-2-enoxy-benzoate

Systemtic Name: ethyl 6-(1,3-benzodioxol-5-yl)-2-methyl-3-[phenyl(prop-2-enyl)amino]-4-prop-2-enoxy-benzoate Openeye Name: ethyl 3-(N-allylanilino)-4-allyloxy-6-(1,3-benzodioxol-5-yl)-2-methyl-benzoate CAS Name: 6-(1,3-benzodioxol-5-yl)-2-methyl-4-prop-2-enoxy-3-(N-prop-2-enylanilino)benzoic acid ethyl ester IUPAC Name: ethyl 6-(1,3-benzodioxol-5-yl)-2-methyl-4-prop-2-enoxy-3-(N-prop-2-enylanilino)benzoate Traditional Name: 3-(N-allylanilino)-4-allyloxy-6-(1,3-benzodioxol-5-yl)-2-methyl-benzoic acid ethyl ester Formula: C29H29NO5 MolecularWeight: 471.54426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1C2=CC3=C(C=C2)OCO3)OCC=C)N(CC=C)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1C2=CC3=C(C=C2)OCO3)OCC=C)N(CC=C)C4=CC=CC=C4)C

InChI

InChI=1S/C29H29NO5/c1-5-15-30(22-11-9-8-10-12-22)28-20(4)27(29(31)32-7-3)23(18-26(28)33-16-6-2)21-13-14-24-25(17-21)35-19-34-24/h5-6,8-14,17-18H,1-2,7,15-16,19H2,3-4H3