(2S)-2-[[(2S)-1-(phenylcarbonyl)pyrrolidin-2-yl]carbonylamino]-3-[(phenylmethyl)carbamoylamino]propanoic acid

Systemtic Name: (2S)-2-[[(2S)-1-(phenylcarbonyl)pyrrolidin-2-yl]carbonylamino]-3-[(phenylmethyl)carbamoylamino]propanoic acid Openeye Name: (2S)-2-[[(2S)-1-benzoylpyrrolidine-2-carbonyl]amino]-3-(benzylcarbamoylamino)propanoic acid CAS Name: (2S)-2-[[[(2S)-1-benzoyl-2-pyrrolidinyl]-oxomethyl]amino]-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propanoic acid IUPAC Name: (2S)-2-[[(2S)-1-benzoylpyrrolidine-2-carbonyl]amino]-3-(benzylcarbamoylamino)propanoic acid Traditional Name: (2S)-2-[[(2S)-1-benzoylprolyl]amino]-3-(benzylcarbamoylamino)propionic acid Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CC=C2)C(=O)NC(CNC(=O)NCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CC=C2)C(=O)N[C@@H](CNC(=O)NCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H26N4O5/c28-20(19-12-7-13-27(19)21(29)17-10-5-2-6-11-17)26-18(22(30)31)15-25-23(32)24-14-16-8-3-1-4-9-16/h1-6,8-11,18-19H,7,12-15H2,(H,26,28)(H,30,31)(H2,24,25,32)/t18-,19-/m0/s1