(2S)-2-[2-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-3-methyl-pentanoic acid

Systemtic Name: (2S)-2-[2-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-3-methyl-pentanoic acid Openeye Name: (2S)-2-[[2-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)acetyl]amino]-3-methyl-pentanoic acid CAS Name: (2S)-2-[[2-(6,7-dimethoxy-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-3-methylpentanoic acid IUPAC Name: (2S)-2-[[2-(6,7-dimethoxy-4-oxoquinazolin-3-yl)acetyl]amino]-3-methylpentanoic acid Traditional Name: (2S)-2-[[2-(4-keto-6,7-dimethoxy-quinazolin-3-yl)acetyl]amino]-3-methyl-valeric acid Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CN1C=NC2=CC(=C(C=C2C1=O)OC)OC

Isomeric SMILES

CCC(C)[C@@H](C(=O)O)NC(=O)CN1C=NC2=CC(=C(C=C2C1=O)OC)OC

InChI

InChI=1S/C18H23N3O6/c1-5-10(2)16(18(24)25)20-15(22)8-21-9-19-12-7-14(27-4)13(26-3)6-11(12)17(21)23/h6-7,9-10,16H,5,8H2,1-4H3,(H,20,22)(H,24,25)/t10?,16-/m0/s1