3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-6-chloranyl-quinazolin-4-one

Systemtic Name: 3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-6-chloranyl-quinazolin-4-one Openeye Name: 3-[2-(1-adamantyl)-2-oxo-ethyl]-6-chloro-quinazolin-4-one CAS Name: 3-[2-(1-adamantyl)-2-oxoethyl]-6-chloro-4-quinazolinone IUPAC Name: 3-[2-(1-adamantyl)-2-oxoethyl]-6-chloroquinazolin-4-one Traditional Name: 3-[2-(1-adamantyl)-2-keto-ethyl]-6-chloro-quinazolin-4-one Formula: C20H21ClN2O2 MolecularWeight: 356.84594

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CN4C=NC5=C(C4=O)C=C(C=C5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CN4C=NC5=C(C4=O)C=C(C=C5)Cl

InChI

InChI=1S/C20H21ClN2O2/c21-15-1-2-17-16(6-15)19(25)23(11-22-17)10-18(24)20-7-12-3-13(8-20)5-14(4-12)9-20/h1-2,6,11-14H,3-5,7-10H2