phenyl 3-[3-[[[2-[bis(azanyl)methylideneamino]phenyl]carbonylamino]methyl]-2-methoxy-phenyl]propanoate

Systemtic Name: phenyl 3-[3-[[[2-[bis(azanyl)methylideneamino]phenyl]carbonylamino]methyl]-2-methoxy-phenyl]propanoate Openeye Name: phenyl 3-[3-[[(2-guanidinobenzoyl)amino]methyl]-2-methoxy-phenyl]propanoate CAS Name: 3-[3-[[[[2-(diaminomethylideneamino)phenyl]-oxomethyl]amino]methyl]-2-methoxyphenyl]propanoic acid phenyl ester IUPAC Name: phenyl 3-[3-[[[2-(diaminomethylideneamino)benzoyl]amino]methyl]-2-methoxyphenyl]propanoate Traditional Name: 3-[3-[[(2-guanidinobenzoyl)amino]methyl]-2-methoxy-phenyl]propionic acid phenyl ester Formula: C25H26N4O4 MolecularWeight: 446.49834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1CNC(=O)C2=CC=CC=C2N=C(N)N)CCC(=O)OC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC=C1CNC(=O)C2=CC=CC=C2N=C(N)N)CCC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C25H26N4O4/c1-32-23-17(14-15-22(30)33-19-10-3-2-4-11-19)8-7-9-18(23)16-28-24(31)20-12-5-6-13-21(20)29-25(26)27/h2-13H,14-16H2,1H3,(H,28,31)(H4,26,27,29)