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

Systemtic Name: N-(3-ethynylphenyl)-6-methoxy-quinazolin-4-amine Openeye Name: N-(3-ethynylphenyl)-6-methoxy-quinazolin-4-amine CAS Name: N-(3-ethynylphenyl)-6-methoxy-4-quinazolinamine IUPAC Name: N-(3-ethynylphenyl)-6-methoxyquinazolin-4-amine Traditional Name: (3-ethynylphenyl)-(6-methoxyquinazolin-4-yl)amine Formula: C17H13N3O MolecularWeight: 275.30462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=CN=C2NC3=CC=CC(=C3)C#C

Isomeric SMILES

COC1=CC2=C(C=C1)N=CN=C2NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C17H13N3O/c1-3-12-5-4-6-13(9-12)20-17-15-10-14(21-2)7-8-16(15)18-11-19-17/h1,4-11H,2H3,(H,18,19,20)