propyl 4-[(6-iodanylquinazolin-4-yl)amino]benzoate

Systemtic Name: propyl 4-[(6-iodanylquinazolin-4-yl)amino]benzoate Openeye Name: propyl 4-[(6-iodoquinazolin-4-yl)amino]benzoate CAS Name: 4-[(6-iodo-4-quinazolinyl)amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(6-iodoquinazolin-4-yl)amino]benzoate Traditional Name: 4-[(6-iodoquinazolin-4-yl)amino]benzoic acid propyl ester Formula: C18H16IN3O2 MolecularWeight: 433.24301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)I

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)I

InChI

InChI=1S/C18H16IN3O2/c1-2-9-24-18(23)12-3-6-14(7-4-12)22-17-15-10-13(19)5-8-16(15)20-11-21-17/h3-8,10-11H,2,9H2,1H3,(H,20,21,22)