6-chloranyl-N-(3-ethynylphenyl)-7-methoxy-quinazolin-4-amine

Systemtic Name: 6-chloranyl-N-(3-ethynylphenyl)-7-methoxy-quinazolin-4-amine Openeye Name: 6-chloro-N-(3-ethynylphenyl)-7-methoxy-quinazolin-4-amine CAS Name: 6-chloro-N-(3-ethynylphenyl)-7-methoxy-4-quinazolinamine IUPAC Name: 6-chloro-N-(3-ethynylphenyl)-7-methoxyquinazolin-4-amine Traditional Name: (6-chloro-7-methoxy-quinazolin-4-yl)-(3-ethynylphenyl)amine Formula: C17H12ClN3O MolecularWeight: 309.74968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)Cl

InChI

InChI=1S/C17H12ClN3O/c1-3-11-5-4-6-12(7-11)21-17-13-8-14(18)16(22-2)9-15(13)19-10-20-17/h1,4-10H,2H3,(H,19,20,21)