2-(1-adamantyl)-4-chloranyl-5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyridazin-3-one

Systemtic Name: 2-(1-adamantyl)-4-chloranyl-5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyridazin-3-one Openeye Name: 2-(1-adamantyl)-4-chloro-5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyridazin-3-one CAS Name: 2-(1-adamantyl)-4-chloro-5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-pyridazinone IUPAC Name: 2-(1-adamantyl)-4-chloro-5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyridazin-3-one Traditional Name: 2-(1-adamantyl)-4-chloro-5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyridazin-3-one Formula: C21H28ClN3O3 MolecularWeight: 405.91832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C3=C(C(=O)N(N=C3)C45CC6CC(C4)CC(C6)C5)Cl

Isomeric SMILES

C1CN(CCC12OCCO2)C3=C(C(=O)N(N=C3)C45CC6CC(C4)CC(C6)C5)Cl

InChI

InChI=1S/C21H28ClN3O3/c22-18-17(24-3-1-21(2-4-24)27-5-6-28-21)13-23-25(19(18)26)20-10-14-7-15(11-20)9-16(8-14)12-20/h13-16H,1-12H2