3-azanyl-5-[4-(furan-2-yl)phenyl]-4-oxidanylidene-2-(phosphonomethylamino)hexanoic acid

Systemtic Name: 3-azanyl-5-[4-(furan-2-yl)phenyl]-4-oxidanylidene-2-(phosphonomethylamino)hexanoic acid Openeye Name: 3-amino-5-[4-(2-furyl)phenyl]-4-oxo-2-(phosphonomethylamino)hexanoic acid CAS Name: 3-amino-5-[4-(2-furanyl)phenyl]-4-oxo-2-(phosphonomethylamino)hexanoic acid IUPAC Name: 3-amino-5-[4-(furan-2-yl)phenyl]-4-oxo-2-(phosphonomethylamino)hexanoic acid Traditional Name: 3-amino-5-[4-(2-furyl)phenyl]-4-keto-2-(phosphonomethylamino)hexanoic acid Formula: C17H21N2O7P MolecularWeight: 396.331601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC=CO2)C(=O)C(C(C(=O)O)NCP(=O)(O)O)N

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC=CO2)C(=O)C(C(C(=O)O)NCP(=O)(O)O)N

InChI

InChI=1S/C17H21N2O7P/c1-10(11-4-6-12(7-5-11)13-3-2-8-26-13)16(20)14(18)15(17(21)22)19-9-27(23,24)25/h2-8,10,14-15,19H,9,18H2,1H3,(H,21,22)(H2,23,24,25)