methyl 4-[[(2S)-6-aminocarbonyl-2-(2-methylpropyl)-3-oxidanylidene-2,4-dihydroquinoxalin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[(2S)-6-aminocarbonyl-2-(2-methylpropyl)-3-oxidanylidene-2,4-dihydroquinoxalin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[(2S)-6-carbamoyl-2-isobutyl-3-oxo-2,4-dihydroquinoxalin-1-yl]methyl]benzoate CAS Name: 4-[[(2S)-6-carbamoyl-2-(2-methylpropyl)-3-oxo-2,4-dihydroquinoxalin-1-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-6-carbamoyl-2-(2-methylpropyl)-3-oxo-2,4-dihydroquinoxalin-1-yl]methyl]benzoate Traditional Name: 4-[[(2S)-6-carbamoyl-2-isobutyl-3-keto-2,4-dihydroquinoxalin-1-yl]methyl]benzoic acid methyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)NC2=C(N1CC3=CC=C(C=C3)C(=O)OC)C=CC(=C2)C(=O)N

Isomeric SMILES

CC(C)C[C@H]1C(=O)NC2=C(N1CC3=CC=C(C=C3)C(=O)OC)C=CC(=C2)C(=O)N

InChI

InChI=1S/C22H25N3O4/c1-13(2)10-19-21(27)24-17-11-16(20(23)26)8-9-18(17)25(19)12-14-4-6-15(7-5-14)22(28)29-3/h4-9,11,13,19H,10,12H2,1-3H3,(H2,23,26)(H,24,27)/t19-/m0/s1