3-azanyl-9-ethynyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one

Systemtic Name: 3-azanyl-9-ethynyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one Openeye Name: 3-amino-9-ethynyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one CAS Name: 3-amino-9-ethynyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one IUPAC Name: 3-amino-9-ethynyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one Traditional Name: 3-amino-9-ethynyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one Formula: C14H11N3O MolecularWeight: 237.25664

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=C(CCC3=C2C(=O)N=C(N3)N)C=C1

Isomeric SMILES

C#CC1=CC2=C(CCC3=C2C(=O)N=C(N3)N)C=C1

InChI

InChI=1S/C14H11N3O/c1-2-8-3-4-9-5-6-11-12(10(9)7-8)13(18)17-14(15)16-11/h1,3-4,7H,5-6H2,(H3,15,16,17,18)