4-[4-(3-chloranyl-6H-benzo[c][1]benzothiepin-11-ylidene)piperidin-1-yl]butan-2-one

Systemtic Name: 4-[4-(3-chloranyl-6H-benzo[c][1]benzothiepin-11-ylidene)piperidin-1-yl]butan-2-one Openeye Name: 4-[4-(3-chloro-6H-benzo[c][1]benzothiepin-11-ylidene)-1-piperidyl]butan-2-one CAS Name: 4-[4-(3-chloro-6H-benzo[c][1]benzothiepin-11-ylidene)-1-piperidinyl]-2-butanone IUPAC Name: 4-[4-(3-chloro-6H-benzo[c][1]benzothiepin-11-ylidene)piperidin-1-yl]butan-2-one Traditional Name: 4-[4-(3-chloro-6H-benzo[c][1]benzothiepin-11-ylidene)piperidino]butan-2-one Formula: C23H24ClNOS MolecularWeight: 397.96076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1CCC(=C2C3=C(C=C(C=C3)Cl)SCC4=CC=CC=C42)CC1

Isomeric SMILES

CC(=O)CCN1CCC(=C2C3=C(C=C(C=C3)Cl)SCC4=CC=CC=C42)CC1

InChI

InChI=1S/C23H24ClNOS/c1-16(26)8-11-25-12-9-17(10-13-25)23-20-5-3-2-4-18(20)15-27-22-14-19(24)6-7-21(22)23/h2-7,14H,8-13,15H2,1H3