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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC2=CC3=C(C=C2)OCCO3)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1NCC2=CC3=C(C=C2)OCCO3)C(=O)[O-]

InChI

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