(E)-4-[1,3-benzodioxol-5-ylmethyl(2-methoxyethyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[1,3-benzodioxol-5-ylmethyl(2-methoxyethyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[1,3-benzodioxol-5-ylmethyl(2-methoxyethyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[1,3-benzodioxol-5-ylmethyl(2-methoxyethyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[1,3-benzodioxol-5-ylmethyl(2-methoxyethyl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[2-methoxyethyl(piperonyl)amino]but-2-enoic acid Formula: C15H17NO6 MolecularWeight: 307.29858

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC2=C(C=C1)OCO2)C(=O)C=CC(=O)O

Isomeric SMILES

COCCN(CC1=CC2=C(C=C1)OCO2)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C15H17NO6/c1-20-7-6-16(14(17)4-5-15(18)19)9-11-2-3-12-13(8-11)22-10-21-12/h2-5,8H,6-7,9-10H2,1H3,(H,18,19)/b5-4+