ethanamine; 2-(3-methylphenyl)-2-oxidanyl-propanedioic acid

Systemtic Name: ethanamine; 2-(3-methylphenyl)-2-oxidanyl-propanedioic acid Openeye Name: ethanamine; 2-hydroxy-2-(m-tolyl)propanedioic acid CAS Name: ethanamine; 2-hydroxy-2-(3-methylphenyl)propanedioic acid IUPAC Name: ethanamine; 2-hydroxy-2-(3-methylphenyl)propanedioic acid Traditional Name: ethylamine; 2-hydroxy-2-(m-tolyl)malonic acid Formula: C12H17NO5 MolecularWeight: 255.26708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10O5.C2H7N/c1-6-3-2-4-7(5-6)10(15,8(11)12)9(13)14;1-2-3/h2-5,15H,1H3,(H,11,12)(H,13,14);2-3H2,1H3