methyl (2S)-2-[3-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)propanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[3-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)propanoylamino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[3-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)propanoylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[3-(6,7-dimethoxy-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)propanoylamino]-4-methylpentanoate Traditional Name: (2S)-2-[3-(4-keto-6,7-dimethoxy-quinazolin-3-yl)propanoylamino]-4-methyl-valeric acid methyl ester Formula: C20H27N3O6 MolecularWeight: 405.44488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CCN1C=NC2=CC(=C(C=C2C1=O)OC)OC

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)CCN1C=NC2=CC(=C(C=C2C1=O)OC)OC

InChI

InChI=1S/C20H27N3O6/c1-12(2)8-15(20(26)29-5)22-18(24)6-7-23-11-21-14-10-17(28-4)16(27-3)9-13(14)19(23)25/h9-12,15H,6-8H2,1-5H3,(H,22,24)/t15-/m0/s1