4-[[(6-methylquinazolin-4-yl)amino]methyl]benzoate

Systemtic Name: 4-[[(6-methylquinazolin-4-yl)amino]methyl]benzoate Openeye Name: 4-[[(6-methylquinazolin-4-yl)amino]methyl]benzoate CAS Name: 4-[[(6-methyl-4-quinazolinyl)amino]methyl]benzoate IUPAC Name: 4-[[(6-methylquinazolin-4-yl)amino]methyl]benzoate Traditional Name: 4-[[(6-methylquinazolin-4-yl)amino]methyl]benzoate Formula: C17H14N3O2- MolecularWeight: 292.31196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=CN=C2NCC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=CN=C2NCC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C17H15N3O2/c1-11-2-7-15-14(8-11)16(20-10-19-15)18-9-12-3-5-13(6-4-12)17(21)22/h2-8,10H,9H2,1H3,(H,21,22)(H,18,19,20)/p-1