2-[[2-(pyridin-4-ylmethylcarbamoylamino)phenyl]carbonylamino]ethanoyl 3-(2-aminophenyl)propanoate

Systemtic Name: 2-[[2-(pyridin-4-ylmethylcarbamoylamino)phenyl]carbonylamino]ethanoyl 3-(2-aminophenyl)propanoate Openeye Name: [2-[[2-(4-pyridylmethylcarbamoylamino)benzoyl]amino]acetyl] 3-(2-aminophenyl)propanoate CAS Name: 3-(2-aminophenyl)propanoic acid [1-oxo-2-[[oxo-[2-[[oxo-(pyridin-4-ylmethylamino)methyl]amino]phenyl]methyl]amino]ethyl] ester IUPAC Name: [2-[[2-(pyridin-4-ylmethylcarbamoylamino)benzoyl]amino]acetyl] 3-(2-aminophenyl)propanoate Traditional Name: 3-(2-aminophenyl)propionic acid [2-[[2-(4-pyridylmethylcarbamoylamino)benzoyl]amino]acetyl] ester Formula: C25H25N5O5 MolecularWeight: 475.4965

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCC(=O)OC(=O)CNC(=O)C2=CC=CC=C2NC(=O)NCC3=CC=NC=C3)N

Isomeric SMILES

C1=CC=C(C(=C1)CCC(=O)OC(=O)CNC(=O)C2=CC=CC=C2NC(=O)NCC3=CC=NC=C3)N

InChI

InChI=1S/C25H25N5O5/c26-20-7-3-1-5-18(20)9-10-22(31)35-23(32)16-28-24(33)19-6-2-4-8-21(19)30-25(34)29-15-17-11-13-27-14-12-17/h1-8,11-14H,9-10,15-16,26H2,(H,28,33)(H2,29,30,34)