methyl 4-oxidanylidene-2-[3-(phenylsulfonylamino)propanoyloxymethyl]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-[3-(phenylsulfonylamino)propanoyloxymethyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[3-(benzenesulfonamido)propanoyloxymethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[3-(benzenesulfonamido)-1-oxopropoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[3-(benzenesulfonamido)propanoyloxymethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[3-(benzenesulfonamido)propanoyloxymethyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H19N3O7S MolecularWeight: 445.44576

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)CCNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)CCNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O7S/c1-29-20(26)13-7-8-15-16(11-13)22-17(23-19(15)25)12-30-18(24)9-10-21-31(27,28)14-5-3-2-4-6-14/h2-8,11,21H,9-10,12H2,1H3,(H,22,23,25)