11-[1-[3-(4-chloranylphenoxy)propyl]piperidin-4-ylidene]-5H-[1]benzoxepino[3,4-b]pyridine

Systemtic Name: 11-[1-[3-(4-chloranylphenoxy)propyl]piperidin-4-ylidene]-5H-[1]benzoxepino[3,4-b]pyridine Openeye Name: 11-[1-[3-(4-chlorophenoxy)propyl]-4-piperidylidene]-5H-[1]benzoxepino[3,4-b]pyridine CAS Name: 11-[1-[3-(4-chlorophenoxy)propyl]-4-piperidinylidene]-5H-[1]benzoxepino[3,4-b]pyridine IUPAC Name: 11-[1-[3-(4-chlorophenoxy)propyl]piperidin-4-ylidene]-5H-[1]benzoxepino[3,4-b]pyridine Traditional Name: 11-[1-[3-(4-chlorophenoxy)propyl]-4-piperidylidene]-5H-[1]benzoxepino[3,4-b]pyridine Formula: C27H27ClN2O2 MolecularWeight: 446.96848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=C2C3=C(COC4=CC=CC=C42)N=CC=C3)CCCOC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1=C2C3=C(COC4=CC=CC=C42)N=CC=C3)CCCOC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H27ClN2O2/c28-21-8-10-22(11-9-21)31-18-4-15-30-16-12-20(13-17-30)27-23-6-3-14-29-25(23)19-32-26-7-2-1-5-24(26)27/h1-3,5-11,14H,4,12-13,15-19H2