ethyl 6-(1,3-benzodioxol-5-yl)-2-methyl-3-phenylazanyl-4-prop-2-enoxy-benzoate

Systemtic Name: ethyl 6-(1,3-benzodioxol-5-yl)-2-methyl-3-phenylazanyl-4-prop-2-enoxy-benzoate Openeye Name: ethyl 4-allyloxy-3-anilino-6-(1,3-benzodioxol-5-yl)-2-methyl-benzoate CAS Name: 3-anilino-6-(1,3-benzodioxol-5-yl)-2-methyl-4-prop-2-enoxybenzoic acid ethyl ester IUPAC Name: ethyl 3-anilino-6-(1,3-benzodioxol-5-yl)-2-methyl-4-prop-2-enoxybenzoate Traditional Name: 4-allyloxy-3-anilino-6-(1,3-benzodioxol-5-yl)-2-methyl-benzoic acid ethyl ester Formula: C26H25NO5 MolecularWeight: 431.4804

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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)NC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1C2=CC3=C(C=C2)OCO3)OCC=C)NC4=CC=CC=C4)C

InChI

InChI=1S/C26H25NO5/c1-4-13-30-23-15-20(18-11-12-21-22(14-18)32-16-31-21)24(26(28)29-5-2)17(3)25(23)27-19-9-7-6-8-10-19/h4,6-12,14-15,27H,1,5,13,16H2,2-3H3