methyl 3-(3H-1,2-benzodioxol-6-ylmethylamino)butanoate

Systemtic Name: methyl 3-(3H-1,2-benzodioxol-6-ylmethylamino)butanoate Openeye Name: methyl 3-(3H-1,2-benzodioxol-6-ylmethylamino)butanoate CAS Name: 3-(3H-1,2-benzodioxol-6-ylmethylamino)butanoic acid methyl ester IUPAC Name: methyl 3-(3H-1,2-benzodioxol-6-ylmethylamino)butanoate Traditional Name: 3-(3H-1,2-benzodioxol-6-ylmethylamino)butyric acid methyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)NCC1=CC2=C(COO2)C=C1

Isomeric SMILES

CC(CC(=O)OC)NCC1=CC2=C(COO2)C=C1

InChI

InChI=1S/C13H17NO4/c1-9(5-13(15)16-2)14-7-10-3-4-11-8-17-18-12(11)6-10/h3-4,6,9,14H,5,7-8H2,1-2H3