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(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-chloranyladamantane-1-carboxylate

(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-chloranyladamantane-1-carboxylate

Systemtic Name:(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-chloranyladamantane-1-carboxylate
Openeye Name:(9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-chloroadamantane-1-carboxylate
CAS Name:3-chloro-1-adamantanecarboxylic acid (9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester
IUPAC Name:(9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-chloroadamantane-1-carboxylate
Traditional Name:3-chloroadamantane-1-carboxylic acid (4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester
Formula: C21H23ClN2O3
MolecularWeight: 386.87192
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)C34CC5CC(C3)CC(C5)(C4)Cl


Isomeric SMILES

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)C34CC5CC(C3)CC(C5)(C4)Cl


InChI

InChI=1S/C21H23ClN2O3/c1-13-3-2-4-24-17(25)6-16(23-18(13)24)11-27-19(26)20-7-14-5-15(8-20)10-21(22,9-14)12-20/h2-4,6,14-15H,5,7-12H2,1H3


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