methyl (2S)-2-[(2,3-diethylquinoxalin-6-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(2,3-diethylquinoxalin-6-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(2,3-diethylquinoxaline-6-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2,3-diethyl-6-quinoxalinyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2,3-diethylquinoxaline-6-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(2,3-diethylquinoxaline-6-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC)N=C1CC

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC)N=C1CC

InChI

InChI=1S/C23H25N3O3/c1-4-17-18(5-2)25-20-14-16(11-12-19(20)24-17)22(27)26-21(23(28)29-3)13-15-9-7-6-8-10-15/h6-12,14,21H,4-5,13H2,1-3H3,(H,26,27)/t21-/m0/s1