2-[[[(2-tert-butylphenyl)amino]methyl-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[[(2-tert-butylphenyl)amino]methyl-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[(2-tert-butylanilino)methyl-hydroxy-phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[(2-tert-butylanilino)methyl-hydroxyphosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[(2-tert-butylanilino)methyl-hydroxyphosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[(2-tert-butylanilino)methyl-hydroxy-phosphoryl]methyl]glutaric acid Formula: C17H26NO6P MolecularWeight: 371.365201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NCP(=O)(CC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NCP(=O)(CC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C17H26NO6P/c1-17(2,3)13-6-4-5-7-14(13)18-11-25(23,24)10-12(16(21)22)8-9-15(19)20/h4-7,12,18H,8-11H2,1-3H3,(H,19,20)(H,21,22)(H,23,24)