methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate

Systemtic Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate Openeye Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoic acid methyl ester IUPAC Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoic acid methyl ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H17NO4/c1-20-17(19)13-3-2-4-14(10-13)18-11-12-5-6-15-16(9-12)22-8-7-21-15/h2-6,9-10,18H,7-8,11H2,1H3