2-azanyl-2-(4-methylphenyl)carbonyl-hexanedioic acid

Systemtic Name: 2-azanyl-2-(4-methylphenyl)carbonyl-hexanedioic acid Openeye Name: 2-amino-2-(4-methylbenzoyl)hexanedioic acid CAS Name: 2-amino-2-[(4-methylphenyl)-oxomethyl]hexanedioic acid IUPAC Name: 2-amino-2-(4-methylbenzoyl)hexanedioic acid Traditional Name: 2-amino-2-p-toluoyl-adipic acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(CCCC(=O)O)(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(CCCC(=O)O)(C(=O)O)N

InChI

InChI=1S/C14H17NO5/c1-9-4-6-10(7-5-9)12(18)14(15,13(19)20)8-2-3-11(16)17/h4-7H,2-3,8,15H2,1H3,(H,16,17)(H,19,20)