6-chloranyl-4-[[5-(4-fluorophenyl)-5-oxidanylidene-pentyl]-piperidin-4-yl-amino]chromen-2-one

Systemtic Name: 6-chloranyl-4-[[5-(4-fluorophenyl)-5-oxidanylidene-pentyl]-piperidin-4-yl-amino]chromen-2-one Openeye Name: 6-chloro-4-[[5-(4-fluorophenyl)-5-oxo-pentyl]-(4-piperidyl)amino]chromen-2-one CAS Name: 6-chloro-4-[[5-(4-fluorophenyl)-5-oxopentyl]-(4-piperidinyl)amino]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[5-(4-fluorophenyl)-5-oxopentyl]-piperidin-4-ylamino]chromen-2-one Traditional Name: 6-chloro-4-[[5-(4-fluorophenyl)-5-keto-pentyl]-(4-piperidyl)amino]coumarin Formula: C25H26ClFN2O3 MolecularWeight: 456.936943

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CCCCC(=O)C2=CC=C(C=C2)F)C3=CC(=O)OC4=C3C=C(C=C4)Cl

Isomeric SMILES

C1CNCCC1N(CCCCC(=O)C2=CC=C(C=C2)F)C3=CC(=O)OC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C25H26ClFN2O3/c26-18-6-9-24-21(15-18)22(16-25(31)32-24)29(20-10-12-28-13-11-20)14-2-1-3-23(30)17-4-7-19(27)8-5-17/h4-9,15-16,20,28H,1-3,10-14H2