methyl 2-[(7-bromanyl-1,3-benzodioxol-5-yl)methylamino]-2-methyl-propanoate

Systemtic Name: methyl 2-[(7-bromanyl-1,3-benzodioxol-5-yl)methylamino]-2-methyl-propanoate Openeye Name: methyl 2-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]-2-methyl-propanoate CAS Name: 2-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]-2-methylpropanoate Traditional Name: 2-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]-2-methyl-propionic acid methyl ester Formula: C13H16BrNO4 MolecularWeight: 330.17444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NCC1=CC2=C(C(=C1)Br)OCO2

Isomeric SMILES

CC(C)(C(=O)OC)NCC1=CC2=C(C(=C1)Br)OCO2

InChI

InChI=1S/C13H16BrNO4/c1-13(2,12(16)17-3)15-6-8-4-9(14)11-10(5-8)18-7-19-11/h4-5,15H,6-7H2,1-3H3