3-[[5-[(4-carbamimidoylphenyl)carbonylamino]-2-phenylmethoxy-phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[5-[(4-carbamimidoylphenyl)carbonylamino]-2-phenylmethoxy-phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[2-benzyloxy-5-[(4-carbamimidoylbenzoyl)amino]benzoyl]amino]propanoic acid CAS Name: 3-[[[5-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-2-phenylmethoxyphenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[5-[(4-carbamimidoylbenzoyl)amino]-2-phenylmethoxybenzoyl]amino]propanoic acid Traditional Name: 3-[[5-[(4-amidinobenzoyl)amino]-2-benzoxy-benzoyl]amino]propionic acid Formula: C25H24N4O5 MolecularWeight: 460.48186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)C(=O)NCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)C(=O)NCCC(=O)O

InChI

InChI=1S/C25H24N4O5/c26-23(27)17-6-8-18(9-7-17)24(32)29-19-10-11-21(34-15-16-4-2-1-3-5-16)20(14-19)25(33)28-13-12-22(30)31/h1-11,14H,12-13,15H2,(H3,26,27)(H,28,33)(H,29,32)(H,30,31)