methyl 2-[2-(1H-indol-3-yl)ethanoyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-(1H-indol-3-yl)ethanoyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[2-(1H-indol-3-yl)acetyl]oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[2-(1H-indol-3-yl)-1-oxoethoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1H-indol-3-yl)acetyl]oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[2-(1H-indol-3-yl)acetyl]oxymethyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)CC3=CNC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O5/c1-28-21(27)12-6-7-15-17(8-12)23-18(24-20(15)26)11-29-19(25)9-13-10-22-16-5-3-2-4-14(13)16/h2-8,10,22H,9,11H2,1H3,(H,23,24,26)