ethanedioic acid; 3-[4-[methyl-(phenylmethyl)amino]butyl]-1,3-benzoxazol-2-one

Systemtic Name: ethanedioic acid; 3-[4-[methyl-(phenylmethyl)amino]butyl]-1,3-benzoxazol-2-one Openeye Name: 3-[4-[benzyl(methyl)amino]butyl]-1,3-benzoxazol-2-one; oxalic acid CAS Name: 3-[4-[methyl-(phenylmethyl)amino]butyl]-1,3-benzoxazol-2-one; oxalic acid IUPAC Name: 3-[4-[benzyl(methyl)amino]butyl]-1,3-benzoxazol-2-one; oxalic acid Traditional Name: 3-[4-[benzyl(methyl)amino]butyl]-1,3-benzoxazol-2-one; oxalic acid Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCN1C2=CC=CC=C2OC1=O)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CCCCN1C2=CC=CC=C2OC1=O)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22N2O2.C2H2O4/c1-20(15-16-9-3-2-4-10-16)13-7-8-14-21-17-11-5-6-12-18(17)23-19(21)22;3-1(4)2(5)6/h2-6,9-12H,7-8,13-15H2,1H3;(H,3,4)(H,5,6)