ethyl (2S)-2-(1,3-benzodioxol-5-ylmethylideneamino)-3-methyl-butanoate

Systemtic Name: ethyl (2S)-2-(1,3-benzodioxol-5-ylmethylideneamino)-3-methyl-butanoate Openeye Name: ethyl (2S)-2-(1,3-benzodioxol-5-ylmethyleneamino)-3-methyl-butanoate CAS Name: (2S)-2-(1,3-benzodioxol-5-ylmethylideneamino)-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(1,3-benzodioxol-5-ylmethylideneamino)-3-methylbutanoate Traditional Name: (2S)-3-methyl-2-(piperonylideneamino)butyric acid ethyl ester Formula: C15H19NO4 MolecularWeight: 277.31566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)N=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCOC(=O)[C@H](C(C)C)N=CC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C15H19NO4/c1-4-18-15(17)14(10(2)3)16-8-11-5-6-12-13(7-11)20-9-19-12/h5-8,10,14H,4,9H2,1-3H3/t14-/m0/s1