1-[(2,4-dimethylphenyl)methyl]-4-methyl-1,4-diazepane; ethanedioic acid

Systemtic Name: 1-[(2,4-dimethylphenyl)methyl]-4-methyl-1,4-diazepane; ethanedioic acid Openeye Name: 1-[(2,4-dimethylphenyl)methyl]-4-methyl-1,4-diazepane; oxalic acid CAS Name: 1-[(2,4-dimethylphenyl)methyl]-4-methyl-1,4-diazepane; oxalic acid IUPAC Name: 1-[(2,4-dimethylphenyl)methyl]-4-methyl-1,4-diazepane; oxalic acid Traditional Name: 1-(2,4-dimethylbenzyl)-4-methyl-1,4-diazepane; oxalic acid Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN2CCCN(CC2)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)CN2CCCN(CC2)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H24N2.C2H2O4/c1-13-5-6-15(14(2)11-13)12-17-8-4-7-16(3)9-10-17;3-1(4)2(5)6/h5-6,11H,4,7-10,12H2,1-3H3;(H,3,4)(H,5,6)