[(4-methylphenyl)-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]methyl]phosphonic acid

Systemtic Name: [(4-methylphenyl)-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]methyl]phosphonic acid Openeye Name: [[4-(2-oxopyrrolidin-1-yl)anilino]-(p-tolyl)methyl]phosphonic acid CAS Name: [(4-methylphenyl)-[4-(2-oxo-1-pyrrolidinyl)anilino]methyl]phosphonic acid IUPAC Name: [(4-methylphenyl)-[4-(2-oxopyrrolidin-1-yl)anilino]methyl]phosphonic acid Traditional Name: [[4-(2-ketopyrrolidino)anilino]-(p-tolyl)methyl]phosphonic acid Formula: C18H21N2O4P MolecularWeight: 360.344101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(NC2=CC=C(C=C2)N3CCCC3=O)P(=O)(O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(NC2=CC=C(C=C2)N3CCCC3=O)P(=O)(O)O

InChI

InChI=1S/C18H21N2O4P/c1-13-4-6-14(7-5-13)18(25(22,23)24)19-15-8-10-16(11-9-15)20-12-2-3-17(20)21/h4-11,18-19H,2-3,12H2,1H3,(H2,22,23,24)