O1-ethyl O6-methyl (2Z)-2-(4-oxidanylidene-2-propan-2-yl-quinazolin-3-yl)iminohexanedioate

Systemtic Name: O1-ethyl O6-methyl (2Z)-2-(4-oxidanylidene-2-propan-2-yl-quinazolin-3-yl)iminohexanedioate Openeye Name: O1-ethyl O6-methyl (2Z)-2-(2-isopropyl-4-oxo-quinazolin-3-yl)iminohexanedioate CAS Name: (2Z)-2-[(4-oxo-2-propan-2-yl-3-quinazolinyl)imino]hexanedioic acid O1-ethyl ester O6-methyl ester IUPAC Name: 1-O-ethyl 6-O-methyl (2Z)-2-(4-oxo-2-propan-2-ylquinazolin-3-yl)iminohexanedioate Traditional Name: (2Z)-2-(2-isopropyl-4-keto-quinazolin-3-yl)iminoadipic acid O1-ethyl ester O6-methyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NN1C(=O)C2=CC=CC=C2N=C1C(C)C)CCCC(=O)OC

Isomeric SMILES

CCOC(=O)/C(=N\N1C(=O)C2=CC=CC=C2N=C1C(C)C)/CCCC(=O)OC

InChI

InChI=1S/C20H25N3O5/c1-5-28-20(26)16(11-8-12-17(24)27-4)22-23-18(13(2)3)21-15-10-7-6-9-14(15)19(23)25/h6-7,9-10,13H,5,8,11-12H2,1-4H3/b22-16-