3-methyl-2-[(3-oxidanylidene-2-propan-2-yl-2,4-dihydroquinoxalin-1-yl)carbonylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[(3-oxidanylidene-2-propan-2-yl-2,4-dihydroquinoxalin-1-yl)carbonylamino]pentanoic acid Openeye Name: 2-[(2-isopropyl-3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]-3-methyl-pentanoic acid CAS Name: 3-methyl-2-[[oxo-(3-oxo-2-propan-2-yl-2,4-dihydroquinoxalin-1-yl)methyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[(3-oxo-2-propan-2-yl-2,4-dihydroquinoxaline-1-carbonyl)amino]pentanoic acid Traditional Name: 2-[(2-isopropyl-3-keto-2,4-dihydroquinoxaline-1-carbonyl)amino]-3-methyl-valeric acid Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)N1C(C(=O)NC2=CC=CC=C21)C(C)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)N1C(C(=O)NC2=CC=CC=C21)C(C)C

InChI

InChI=1S/C18H25N3O4/c1-5-11(4)14(17(23)24)20-18(25)21-13-9-7-6-8-12(13)19-16(22)15(21)10(2)3/h6-11,14-15H,5H2,1-4H3,(H,19,22)(H,20,25)(H,23,24)