ethyl 3-azanyl-3-(7-bromanyl-1,3-benzodioxol-5-yl)propanoate

Systemtic Name: ethyl 3-azanyl-3-(7-bromanyl-1,3-benzodioxol-5-yl)propanoate Openeye Name: ethyl 3-amino-3-(7-bromo-1,3-benzodioxol-5-yl)propanoate CAS Name: 3-amino-3-(7-bromo-1,3-benzodioxol-5-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-amino-3-(7-bromo-1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-amino-3-(7-bromo-1,3-benzodioxol-5-yl)propionic acid ethyl ester Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC2=C(C(=C1)Br)OCO2)N

Isomeric SMILES

CCOC(=O)CC(C1=CC2=C(C(=C1)Br)OCO2)N

InChI

InChI=1S/C12H14BrNO4/c1-2-16-11(15)5-9(14)7-3-8(13)12-10(4-7)17-6-18-12/h3-4,9H,2,5-6,14H2,1H3