4-[[2,3-dihydro-1,4-benzodioxin-6-yl(methyl)amino]methyl]benzoate

Systemtic Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-yl(methyl)amino]methyl]benzoate Openeye Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-yl(methyl)amino]methyl]benzoate CAS Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-yl(methyl)amino]methyl]benzoate IUPAC Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-yl(methyl)amino]methyl]benzoate Traditional Name: 4-[[2,3-dihydro-1,4-benzodioxin-6-yl(methyl)amino]methyl]benzoate Formula: C17H16NO4- MolecularWeight: 298.31324

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)[O-])C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)[O-])C2=CC3=C(C=C2)OCCO3

InChI

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