4-[(3-ethynylphenyl)amino]-6-oxidanyl-1H-quinazolin-7-one

Systemtic Name: 4-[(3-ethynylphenyl)amino]-6-oxidanyl-1H-quinazolin-7-one Openeye Name: 4-(3-ethynylanilino)-6-hydroxy-1H-quinazolin-7-one CAS Name: 4-(3-ethynylanilino)-6-hydroxy-1H-quinazolin-7-one IUPAC Name: 4-(3-ethynylanilino)-6-hydroxy-1H-quinazolin-7-one Traditional Name: 4-(3-ethynylanilino)-6-hydroxy-1H-quinazolin-7-one Formula: C16H11N3O2 MolecularWeight: 277.27744

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=C3C=C(C(=O)C=C3NC=N2)O

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=C3C=C(C(=O)C=C3NC=N2)O

InChI

InChI=1S/C16H11N3O2/c1-2-10-4-3-5-11(6-10)19-16-12-7-14(20)15(21)8-13(12)17-9-18-16/h1,3-9,19-20H,(H,17,18)