[[7-fluoranyl-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl-(phenylmethyl)amino]methylphosphonic acid

Systemtic Name: [[7-fluoranyl-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl-(phenylmethyl)amino]methylphosphonic acid Openeye Name: [benzyl-[(7-fluoro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]amino]methylphosphonic acid CAS Name: [(7-fluoro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl-(phenylmethyl)amino]methylphosphonic acid IUPAC Name: [benzyl-[(7-fluoro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]amino]methylphosphonic acid Traditional Name: [benzyl-[(7-fluoro-2,3-diketo-1,4-dihydroquinoxalin-5-yl)methyl]amino]methylphosphonic acid Formula: C17H17FN3O5P MolecularWeight: 393.306144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC(=CC3=C2NC(=O)C(=O)N3)F)CP(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC(=CC3=C2NC(=O)C(=O)N3)F)CP(=O)(O)O

InChI

InChI=1S/C17H17FN3O5P/c18-13-6-12(15-14(7-13)19-16(22)17(23)20-15)9-21(10-27(24,25)26)8-11-4-2-1-3-5-11/h1-7H,8-10H2,(H,19,22)(H,20,23)(H2,24,25,26)