2-[[(2S)-2-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)carbonylamino]-3-phenyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[(2S)-2-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)carbonylamino]-3-phenyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[[(2S)-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]-3-phenyl-propanoyl]amino]acetic acid CAS Name: 2-[[(2S)-1-oxo-2-[[oxo-(3-oxo-2,4-dihydroquinoxalin-1-yl)methyl]amino]-3-phenylpropyl]amino]acetic acid IUPAC Name: 2-[[(2S)-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]-3-phenylpropanoyl]amino]acetic acid Traditional Name: 2-[[(2S)-2-[(3-keto-2,4-dihydroquinoxaline-1-carbonyl)amino]-3-phenyl-propanoyl]amino]acetic acid Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC=CC=C2N1C(=O)NC(CC3=CC=CC=C3)C(=O)NCC(=O)O

Isomeric SMILES

C1C(=O)NC2=CC=CC=C2N1C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)NCC(=O)O

InChI

InChI=1S/C20H20N4O5/c25-17-12-24(16-9-5-4-8-14(16)22-17)20(29)23-15(19(28)21-11-18(26)27)10-13-6-2-1-3-7-13/h1-9,15H,10-12H2,(H,21,28)(H,22,25)(H,23,29)(H,26,27)/t15-/m0/s1