3-[[2-[[(4-acetamidophenyl)-phosphono-methyl]amino]-3-(4-phenylphenyl)propanoyl]amino]propanoate

Systemtic Name: 3-[[2-[[(4-acetamidophenyl)-phosphono-methyl]amino]-3-(4-phenylphenyl)propanoyl]amino]propanoate Openeye Name: 3-[[2-[[(4-acetamidophenyl)-phosphono-methyl]amino]-3-(4-phenylphenyl)propanoyl]amino]propanoate CAS Name: 3-[[2-[[(4-acetamidophenyl)-phosphonomethyl]amino]-1-oxo-3-(4-phenylphenyl)propyl]amino]propanoate IUPAC Name: 3-[[2-[[(4-acetamidophenyl)-phosphonomethyl]amino]-3-(4-phenylphenyl)propanoyl]amino]propanoate Traditional Name: 3-[[2-[[(4-acetamidophenyl)-phosphono-methyl]amino]-3-(4-phenylphenyl)propanoyl]amino]propionate Formula: C27H29N3O7P- MolecularWeight: 538.508821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(NC(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)NCCC(=O)[O-])P(=O)(O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(NC(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)NCCC(=O)[O-])P(=O)(O)O

InChI

InChI=1S/C27H30N3O7P/c1-18(31)29-23-13-11-22(12-14-23)27(38(35,36)37)30-24(26(34)28-16-15-25(32)33)17-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-14,24,27,30H,15-17H2,1H3,(H,28,34)(H,29,31)(H,32,33)(H2,35,36,37)/p-1