3-[2-[[3-[(phenylmethyl)carbamoylamino]phenyl]carbonylamino]ethanoylamino]propanoic acid

Systemtic Name: 3-[2-[[3-[(phenylmethyl)carbamoylamino]phenyl]carbonylamino]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]propanoic acid CAS Name: 3-[[1-oxo-2-[[oxo-[3-[[oxo-[(phenylmethyl)amino]methyl]amino]phenyl]methyl]amino]ethyl]amino]propanoic acid IUPAC Name: 3-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]propanoic acid Traditional Name: 3-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]propionic acid Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=CC=CC(=C2)C(=O)NCC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=CC=CC(=C2)C(=O)NCC(=O)NCCC(=O)O

InChI

InChI=1S/C20H22N4O5/c25-17(21-10-9-18(26)27)13-22-19(28)15-7-4-8-16(11-15)24-20(29)23-12-14-5-2-1-3-6-14/h1-8,11H,9-10,12-13H2,(H,21,25)(H,22,28)(H,26,27)(H2,23,24,29)