[[(4-methylphenyl)amino]-(4-oxidanylidenechromen-2-yl)methyl]phosphonic acid

Systemtic Name: [[(4-methylphenyl)amino]-(4-oxidanylidenechromen-2-yl)methyl]phosphonic acid Openeye Name: [(4-methylanilino)-(4-oxochromen-2-yl)methyl]phosphonic acid CAS Name: [(4-methylanilino)-(4-oxo-1-benzopyran-2-yl)methyl]phosphonic acid IUPAC Name: [(4-methylanilino)-(4-oxochromen-2-yl)methyl]phosphonic acid Traditional Name: [(4-ketochromen-2-yl)-(p-toluidino)methyl]phosphonic acid Formula: C17H16NO5P MolecularWeight: 345.286401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(C2=CC(=O)C3=CC=CC=C3O2)P(=O)(O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(C2=CC(=O)C3=CC=CC=C3O2)P(=O)(O)O

InChI

InChI=1S/C17H16NO5P/c1-11-6-8-12(9-7-11)18-17(24(20,21)22)16-10-14(19)13-4-2-3-5-15(13)23-16/h2-10,17-18H,1H3,(H2,20,21,22)