6-chloranyl-7-ethynyl-3-[2-oxidanylidene-3-(3-oxidanylpyrrolidin-2-yl)propyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-7-ethynyl-3-[2-oxidanylidene-3-(3-oxidanylpyrrolidin-2-yl)propyl]quinazolin-4-one Openeye Name: 6-chloro-7-ethynyl-3-[3-(3-hydroxypyrrolidin-2-yl)-2-oxo-propyl]quinazolin-4-one CAS Name: 6-chloro-7-ethynyl-3-[3-(3-hydroxy-2-pyrrolidinyl)-2-oxopropyl]-4-quinazolinone IUPAC Name: 6-chloro-7-ethynyl-3-[3-(3-hydroxypyrrolidin-2-yl)-2-oxopropyl]quinazolin-4-one Traditional Name: 6-chloro-7-ethynyl-3-[3-(3-hydroxypyrrolidin-2-yl)-2-keto-propyl]quinazolin-4-one Formula: C17H16ClN3O3 MolecularWeight: 345.78024

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=C(C=C1Cl)C(=O)N(C=N2)CC(=O)CC3C(CCN3)O

Isomeric SMILES

C#CC1=CC2=C(C=C1Cl)C(=O)N(C=N2)CC(=O)CC3C(CCN3)O

InChI

InChI=1S/C17H16ClN3O3/c1-2-10-5-14-12(7-13(10)18)17(24)21(9-20-14)8-11(22)6-15-16(23)3-4-19-15/h1,5,7,9,15-16,19,23H,3-4,6,8H2