2-[(2-chloranylquinazolin-4-yl)amino]-5-methyl-benzoate

Systemtic Name: 2-[(2-chloranylquinazolin-4-yl)amino]-5-methyl-benzoate Openeye Name: 2-[(2-chloroquinazolin-4-yl)amino]-5-methyl-benzoate CAS Name: 2-[(2-chloro-4-quinazolinyl)amino]-5-methylbenzoate IUPAC Name: 2-[(2-chloroquinazolin-4-yl)amino]-5-methylbenzoate Traditional Name: 2-[(2-chloroquinazolin-4-yl)amino]-5-methyl-benzoate Formula: C16H11ClN3O2- MolecularWeight: 312.73044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NC(=NC3=CC=CC=C32)Cl)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NC(=NC3=CC=CC=C32)Cl)C(=O)[O-]

InChI

InChI=1S/C16H12ClN3O2/c1-9-6-7-13(11(8-9)15(21)22)18-14-10-4-2-3-5-12(10)19-16(17)20-14/h2-8H,1H3,(H,21,22)(H,18,19,20)/p-1