2-[[(2S,3S)-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)pentanoyl]amino]ethanoate

Systemtic Name: 2-[[(2S,3S)-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)pentanoyl]amino]ethanoate Openeye Name: 2-[[(2S,3S)-3-methyl-2-(4-oxoquinazolin-3-yl)pentanoyl]amino]acetate CAS Name: 2-[[(2S,3S)-3-methyl-1-oxo-2-(4-oxo-3-quinazolinyl)pentyl]amino]acetate IUPAC Name: 2-[[(2S,3S)-3-methyl-2-(4-oxoquinazolin-3-yl)pentanoyl]amino]acetate Traditional Name: 2-[[(2S,3S)-2-(4-ketoquinazolin-3-yl)-3-methyl-pentanoyl]amino]acetate Formula: C16H18N3O4- MolecularWeight: 316.33182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC(=O)[O-])N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCC(=O)[O-])N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C16H19N3O4/c1-3-10(2)14(15(22)17-8-13(20)21)19-9-18-12-7-5-4-6-11(12)16(19)23/h4-7,9-10,14H,3,8H2,1-2H3,(H,17,22)(H,20,21)/p-1/t10-,14-/m0/s1