N-(3-chloranyl-4-phenoxy-phenyl)-2-ethynyl-7-(2-methoxyethoxy)quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-phenoxy-phenyl)-2-ethynyl-7-(2-methoxyethoxy)quinazolin-4-amine Openeye Name: N-(3-chloro-4-phenoxy-phenyl)-2-ethynyl-7-(2-methoxyethoxy)quinazolin-4-amine CAS Name: N-(3-chloro-4-phenoxyphenyl)-2-ethynyl-7-(2-methoxyethoxy)-4-quinazolinamine IUPAC Name: N-(3-chloro-4-phenoxyphenyl)-2-ethynyl-7-(2-methoxyethoxy)quinazolin-4-amine Traditional Name: (3-chloro-4-phenoxy-phenyl)-[2-ethynyl-7-(2-methoxyethoxy)quinazolin-4-yl]amine Formula: C25H20ClN3O3 MolecularWeight: 445.8976

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC2=C(C=C1)C(=NC(=N2)C#C)NC3=CC(=C(C=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

COCCOC1=CC2=C(C=C1)C(=NC(=N2)C#C)NC3=CC(=C(C=C3)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H20ClN3O3/c1-3-24-28-22-16-19(31-14-13-30-2)10-11-20(22)25(29-24)27-17-9-12-23(21(26)15-17)32-18-7-5-4-6-8-18/h1,4-12,15-16H,13-14H2,2H3,(H,27,28,29)