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

Systemtic Name: 2-methylpropyl 4-[(6-iodanylquinazolin-4-yl)amino]benzoate Openeye Name: isobutyl 4-[(6-iodoquinazolin-4-yl)amino]benzoate CAS Name: 4-[(6-iodo-4-quinazolinyl)amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(6-iodoquinazolin-4-yl)amino]benzoate Traditional Name: 4-[(6-iodoquinazolin-4-yl)amino]benzoic acid isobutyl ester Formula: C19H18IN3O2 MolecularWeight: 447.26959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18IN3O2/c1-12(2)10-25-19(24)13-3-6-15(7-4-13)23-18-16-9-14(20)5-8-17(16)21-11-22-18/h3-9,11-12H,10H2,1-2H3,(H,21,22,23)