[(E)-2-(2-acetyloxyethyl)-4-azanyl-5-oxidanylidene-5-phenylmethoxy-pent-2-enyl]phosphonic acid

Systemtic Name: [(E)-2-(2-acetyloxyethyl)-4-azanyl-5-oxidanylidene-5-phenylmethoxy-pent-2-enyl]phosphonic acid Openeye Name: [(E)-2-(2-acetoxyethyl)-4-amino-5-benzyloxy-5-oxo-pent-2-enyl]phosphonic acid CAS Name: [(E)-2-(2-acetyloxyethyl)-4-amino-5-oxo-5-phenylmethoxypent-2-enyl]phosphonic acid IUPAC Name: [(E)-2-(2-acetyloxyethyl)-4-amino-5-oxo-5-phenylmethoxypent-2-enyl]phosphonic acid Traditional Name: [(E)-2-(2-acetoxyethyl)-4-amino-5-benzoxy-5-keto-pent-2-enyl]phosphonic acid Formula: C16H22NO7P MolecularWeight: 371.322141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC(=CC(C(=O)OCC1=CC=CC=C1)N)CP(=O)(O)O

Isomeric SMILES

CC(=O)OCC/C(=C\C(C(=O)OCC1=CC=CC=C1)N)/CP(=O)(O)O

InChI

InChI=1S/C16H22NO7P/c1-12(18)23-8-7-14(11-25(20,21)22)9-15(17)16(19)24-10-13-5-3-2-4-6-13/h2-6,9,15H,7-8,10-11,17H2,1H3,(H2,20,21,22)/b14-9+