methyl 2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(2S)-2-benzamido-1-oxopropoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=NC(=O)C2=C(N1)C=C(C=C2)C(=O)OC)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OCC1=NC(=O)C2=C(N1)C=C(C=C2)C(=O)OC)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O6/c1-12(22-18(25)13-6-4-3-5-7-13)20(27)30-11-17-23-16-10-14(21(28)29-2)8-9-15(16)19(26)24-17/h3-10,12H,11H2,1-2H3,(H,22,25)(H,23,24,26)/t12-/m0/s1