3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(ethyl)amino]benzoate

Systemtic Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(ethyl)amino]benzoate Openeye Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(ethyl)amino]benzoate CAS Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(ethyl)amino]benzoate IUPAC Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(ethyl)amino]benzoate Traditional Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(ethyl)amino]benzoate Formula: C18H18NO4- MolecularWeight: 312.33982

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCCO2)C3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCCO2)C3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C18H19NO4/c1-2-19(15-5-3-4-14(11-15)18(20)21)12-13-6-7-16-17(10-13)23-9-8-22-16/h3-7,10-11H,2,8-9,12H2,1H3,(H,20,21)/p-1