methyl 3-(1,3-benzodioxol-4-ylmethylamino)benzoate

Systemtic Name: methyl 3-(1,3-benzodioxol-4-ylmethylamino)benzoate Openeye Name: methyl 3-(1,3-benzodioxol-4-ylmethylamino)benzoate CAS Name: 3-(1,3-benzodioxol-4-ylmethylamino)benzoic acid methyl ester IUPAC Name: methyl 3-(1,3-benzodioxol-4-ylmethylamino)benzoate Traditional Name: 3-(1,3-benzodioxol-4-ylmethylamino)benzoic acid methyl ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NCC2=C3C(=CC=C2)OCO3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NCC2=C3C(=CC=C2)OCO3

InChI

InChI=1S/C16H15NO4/c1-19-16(18)11-4-2-6-13(8-11)17-9-12-5-3-7-14-15(12)21-10-20-14/h2-8,17H,9-10H2,1H3