4-[4-(6H-benzo[c][1]benzothiepin-11-ylidene)piperidin-1-yl]butanoic acid

Systemtic Name: 4-[4-(6H-benzo[c][1]benzothiepin-11-ylidene)piperidin-1-yl]butanoic acid Openeye Name: 4-[4-(6H-benzo[c][1]benzothiepin-11-ylidene)-1-piperidyl]butanoic acid CAS Name: 4-[4-(6H-benzo[c][1]benzothiepin-11-ylidene)-1-piperidinyl]butanoic acid IUPAC Name: 4-[4-(6H-benzo[c][1]benzothiepin-11-ylidene)piperidin-1-yl]butanoic acid Traditional Name: 4-[4-(6H-benzo[c][1]benzothiepin-11-ylidene)piperidino]butyric acid Formula: C23H25NO2S MolecularWeight: 379.5151

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=C2C3=CC=CC=C3CSC4=CC=CC=C42)CCCC(=O)O

Isomeric SMILES

C1CN(CCC1=C2C3=CC=CC=C3CSC4=CC=CC=C42)CCCC(=O)O

InChI

InChI=1S/C23H25NO2S/c25-22(26)10-5-13-24-14-11-17(12-15-24)23-19-7-2-1-6-18(19)16-27-21-9-4-3-8-20(21)23/h1-4,6-9H,5,10-16H2,(H,25,26)