propyl 4-[[2-oxidanyl-3-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)propyl]amino]benzoate

Systemtic Name: propyl 4-[[2-oxidanyl-3-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)propyl]amino]benzoate Openeye Name: propyl 4-[[2-hydroxy-3-(4-oxo-2-phenyl-quinazolin-3-yl)propyl]amino]benzoate CAS Name: 4-[[2-hydroxy-3-(4-oxo-2-phenyl-3-quinazolinyl)propyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-hydroxy-3-(4-oxo-2-phenylquinazolin-3-yl)propyl]amino]benzoate Traditional Name: 4-[[2-hydroxy-3-(4-keto-2-phenyl-quinazolin-3-yl)propyl]amino]benzoic acid propyl ester Formula: C27H27N3O4 MolecularWeight: 457.52098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NCC(CN2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4)O

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NCC(CN2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4)O

InChI

InChI=1S/C27H27N3O4/c1-2-16-34-27(33)20-12-14-21(15-13-20)28-17-22(31)18-30-25(19-8-4-3-5-9-19)29-24-11-7-6-10-23(24)26(30)32/h3-15,22,28,31H,2,16-18H2,1H3