(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 1-(4-fluorobenzoyl)piperidine-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 1-(4-fluorobenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-fluorobenzoyl)nipecotic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H21ClFNO5 MolecularWeight: 457.878643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)F)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)F)Cl

InChI

InChI=1S/C24H21ClFNO5/c1-14-9-21-19(11-20(14)25)17(10-22(28)32-21)13-31-24(30)16-3-2-8-27(12-16)23(29)15-4-6-18(26)7-5-15/h4-7,9-11,16H,2-3,8,12-13H2,1H3