3-[3-[(3-chlorophenyl)methyl-methyl-amino]propyl]-1,3-benzoxazol-2-one; ethanedioic acid

Systemtic Name: 3-[3-[(3-chlorophenyl)methyl-methyl-amino]propyl]-1,3-benzoxazol-2-one; ethanedioic acid Openeye Name: 3-[3-[(3-chlorophenyl)methyl-methyl-amino]propyl]-1,3-benzoxazol-2-one; oxalic acid CAS Name: 3-[3-[(3-chlorophenyl)methyl-methylamino]propyl]-1,3-benzoxazol-2-one; oxalic acid IUPAC Name: 3-[3-[(3-chlorophenyl)methyl-methylamino]propyl]-1,3-benzoxazol-2-one; oxalic acid Traditional Name: 3-[3-[(3-chlorobenzyl)-methyl-amino]propyl]-1,3-benzoxazol-2-one; oxalic acid Formula: C20H21ClN2O6 MolecularWeight: 420.84354

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1C2=CC=CC=C2OC1=O)CC3=CC(=CC=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CCCN1C2=CC=CC=C2OC1=O)CC3=CC(=CC=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H19ClN2O2.C2H2O4/c1-20(13-14-6-4-7-15(19)12-14)10-5-11-21-16-8-2-3-9-17(16)23-18(21)22;3-1(4)2(5)6/h2-4,6-9,12H,5,10-11,13H2,1H3;(H,3,4)(H,5,6)