ethanedioic acid; 8-methoxy-3-phenethyl-2,4-dihydro-1,3-benzoxazine

Systemtic Name: ethanedioic acid; 8-methoxy-3-phenethyl-2,4-dihydro-1,3-benzoxazine Openeye Name: 8-methoxy-3-phenethyl-2,4-dihydro-1,3-benzoxazine; oxalic acid CAS Name: 8-methoxy-3-phenethyl-2,4-dihydro-1,3-benzoxazine; oxalic acid IUPAC Name: 8-methoxy-3-phenethyl-2,4-dihydro-1,3-benzoxazine; oxalic acid Traditional Name: 8-methoxy-3-phenethyl-2,4-dihydro-1,3-benzoxazine; oxalic acid Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OCN(C2)CCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC2=C1OCN(C2)CCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H19NO2.C2H2O4/c1-19-16-9-5-8-15-12-18(13-20-17(15)16)11-10-14-6-3-2-4-7-14;3-1(4)2(5)6/h2-9H,10-13H2,1H3;(H,3,4)(H,5,6)