5-[4-[2,7-bis(chloranyl)xanthen-9-ylidene]piperidin-1-yl]pentan-2-one

Systemtic Name: 5-[4-[2,7-bis(chloranyl)xanthen-9-ylidene]piperidin-1-yl]pentan-2-one Openeye Name: 5-[4-(2,7-dichloroxanthen-9-ylidene)-1-piperidyl]pentan-2-one CAS Name: 5-[4-(2,7-dichloro-9-xanthenylidene)-1-piperidinyl]-2-pentanone IUPAC Name: 5-[4-(2,7-dichloroxanthen-9-ylidene)piperidin-1-yl]pentan-2-one Traditional Name: 5-[4-(2,7-dichloroxanthen-9-ylidene)piperidino]pentan-2-one Formula: C23H23Cl2NO2 MolecularWeight: 416.34022

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCN1CCC(=C2C3=C(C=CC(=C3)Cl)OC4=C2C=C(C=C4)Cl)CC1

Isomeric SMILES

CC(=O)CCCN1CCC(=C2C3=C(C=CC(=C3)Cl)OC4=C2C=C(C=C4)Cl)CC1

InChI

InChI=1S/C23H23Cl2NO2/c1-15(27)3-2-10-26-11-8-16(9-12-26)23-19-13-17(24)4-6-21(19)28-22-7-5-18(25)14-20(22)23/h4-7,13-14H,2-3,8-12H2,1H3