2-[[[(4-methylphenyl)amino]methyl-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[[(4-methylphenyl)amino]methyl-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[hydroxy-[(4-methylanilino)methyl]phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy-[(4-methylanilino)methyl]phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[hydroxy-[(4-methylanilino)methyl]phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[hydroxy(p-toluidinomethyl)phosphoryl]methyl]glutaric acid Formula: C14H20NO6P MolecularWeight: 329.285461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCP(=O)(CC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)NCP(=O)(CC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C14H20NO6P/c1-10-2-5-12(6-3-10)15-9-22(20,21)8-11(14(18)19)4-7-13(16)17/h2-3,5-6,11,15H,4,7-9H2,1H3,(H,16,17)(H,18,19)(H,20,21)