methyl 4-chloranyl-3-[(6-ethylquinazolin-4-yl)amino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[(6-ethylquinazolin-4-yl)amino]benzoate Openeye Name: methyl 4-chloro-3-[(6-ethylquinazolin-4-yl)amino]benzoate CAS Name: 4-chloro-3-[(6-ethyl-4-quinazolinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[(6-ethylquinazolin-4-yl)amino]benzoate Traditional Name: 4-chloro-3-[(6-ethylquinazolin-4-yl)amino]benzoic acid methyl ester Formula: C18H16ClN3O2 MolecularWeight: 341.79154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=CN=C2NC3=C(C=CC(=C3)C(=O)OC)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)N=CN=C2NC3=C(C=CC(=C3)C(=O)OC)Cl

InChI

InChI=1S/C18H16ClN3O2/c1-3-11-4-7-15-13(8-11)17(21-10-20-15)22-16-9-12(18(23)24-2)5-6-14(16)19/h4-10H,3H2,1-2H3,(H,20,21,22)