propan-2-yl 4-[(6-iodanylquinazolin-4-yl)amino]benzoate

Systemtic Name: propan-2-yl 4-[(6-iodanylquinazolin-4-yl)amino]benzoate Openeye Name: isopropyl 4-[(6-iodoquinazolin-4-yl)amino]benzoate CAS Name: 4-[(6-iodo-4-quinazolinyl)amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(6-iodoquinazolin-4-yl)amino]benzoate Traditional Name: 4-[(6-iodoquinazolin-4-yl)amino]benzoic acid isopropyl ester Formula: C18H16IN3O2 MolecularWeight: 433.24301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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