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

Systemtic Name: 3-[3-[(2,4-dimethylphenyl)methyl-methyl-amino]propyl]-1,3-benzoxazol-2-one; ethanedioic acid Openeye Name: 3-[3-[(2,4-dimethylphenyl)methyl-methyl-amino]propyl]-1,3-benzoxazol-2-one; oxalic acid CAS Name: 3-[3-[(2,4-dimethylphenyl)methyl-methylamino]propyl]-1,3-benzoxazol-2-one; oxalic acid IUPAC Name: 3-[3-[(2,4-dimethylphenyl)methyl-methylamino]propyl]-1,3-benzoxazol-2-one; oxalic acid Traditional Name: 3-[3-[(2,4-dimethylbenzyl)-methyl-amino]propyl]-1,3-benzoxazol-2-one; oxalic acid Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)CCCN2C3=CC=CC=C3OC2=O)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)CCCN2C3=CC=CC=C3OC2=O)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H24N2O2.C2H2O4/c1-15-9-10-17(16(2)13-15)14-21(3)11-6-12-22-18-7-4-5-8-19(18)24-20(22)23;3-1(4)2(5)6/h4-5,7-10,13H,6,11-12,14H2,1-3H3;(H,3,4)(H,5,6)