1-[3-(2,2-dimethylpropanoyloxymethyl)-2,7-dimethyl-4-oxidanylidene-quinazolin-6-yl]ethyl 2-azanylbenzoate

Systemtic Name: 1-[3-(2,2-dimethylpropanoyloxymethyl)-2,7-dimethyl-4-oxidanylidene-quinazolin-6-yl]ethyl 2-azanylbenzoate Openeye Name: 1-[3-(2,2-dimethylpropanoyloxymethyl)-2,7-dimethyl-4-oxo-quinazolin-6-yl]ethyl 2-aminobenzoate CAS Name: 2-aminobenzoic acid 1-[3-[(2,2-dimethyl-1-oxopropoxy)methyl]-2,7-dimethyl-4-oxo-6-quinazolinyl]ethyl ester IUPAC Name: 1-[3-(2,2-dimethylpropanoyloxymethyl)-2,7-dimethyl-4-oxoquinazolin-6-yl]ethyl 2-aminobenzoate Traditional Name: 2-aminobenzoic acid 1-[4-keto-2,7-dimethyl-3-(pivaloyloxymethyl)quinazolin-6-yl]ethyl ester Formula: C25H29N3O5 MolecularWeight: 451.51486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)N=C(N(C2=O)COC(=O)C(C)(C)C)C)C(C)OC(=O)C3=CC=CC=C3N

Isomeric SMILES

CC1=C(C=C2C(=C1)N=C(N(C2=O)COC(=O)C(C)(C)C)C)C(C)OC(=O)C3=CC=CC=C3N

InChI

InChI=1S/C25H29N3O5/c1-14-11-21-19(22(29)28(16(3)27-21)13-32-24(31)25(4,5)6)12-18(14)15(2)33-23(30)17-9-7-8-10-20(17)26/h7-12,15H,13,26H2,1-6H3