2-(2-dimethylaminoethyl)-2-[(3-methylphenyl)methyl]propanedioic acid

Systemtic Name: 2-(2-dimethylaminoethyl)-2-[(3-methylphenyl)methyl]propanedioic acid Openeye Name: 2-(2-dimethylaminoethyl)-2-(m-tolylmethyl)propanedioic acid CAS Name: 2-(2-dimethylaminoethyl)-2-[(3-methylphenyl)methyl]propanedioic acid IUPAC Name: 2-(2-dimethylaminoethyl)-2-[(3-methylphenyl)methyl]propanedioic acid Traditional Name: 2-(2-dimethylaminoethyl)-2-(3-methylbenzyl)malonic acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(CCN(C)C)(C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CC(CCN(C)C)(C(=O)O)C(=O)O

InChI

InChI=1S/C15H21NO4/c1-11-5-4-6-12(9-11)10-15(13(17)18,14(19)20)7-8-16(2)3/h4-6,9H,7-8,10H2,1-3H3,(H,17,18)(H,19,20)