(5Z)-5-[3-[4-azido-4-(4-chlorophenyl)piperidin-1-yl]propylidene]-7-methoxy-6H-[1]benzoxepino[2,3-b]pyridine

Systemtic Name: (5Z)-5-[3-[4-azido-4-(4-chlorophenyl)piperidin-1-yl]propylidene]-7-methoxy-6H-[1]benzoxepino[2,3-b]pyridine Openeye Name: (5Z)-5-[3-[4-azido-4-(4-chlorophenyl)-1-piperidyl]propylidene]-7-methoxy-6H-[1]benzoxepino[2,3-b]pyridine CAS Name: (5Z)-5-[3-[4-azido-4-(4-chlorophenyl)-1-piperidinyl]propylidene]-7-methoxy-6H-[1]benzoxepino[2,3-b]pyridine IUPAC Name: (5Z)-5-[3-[4-azido-4-(4-chlorophenyl)piperidin-1-yl]propylidene]-7-methoxy-6H-[1]benzoxepino[2,3-b]pyridine Traditional Name: (5Z)-5-[3-[4-azido-4-(4-chlorophenyl)piperidino]propylidene]-7-methoxy-6H-[1]benzoxepino[2,3-b]pyridine Formula: C28H28ClN5O2 MolecularWeight: 502.00722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CC(=CCCN3CCC(CC3)(C4=CC=C(C=C4)Cl)N=[N+]=[N-])C5=C(O2)N=CC=C5

Isomeric SMILES

COC1=CC=CC2=C1C/C(=C/CCN3CCC(CC3)(C4=CC=C(C=C4)Cl)N=[N+]=[N-])/C5=C(O2)N=CC=C5

InChI

InChI=1S/C28H28ClN5O2/c1-35-25-7-2-8-26-24(25)19-20(23-6-3-15-31-27(23)36-26)5-4-16-34-17-13-28(14-18-34,32-33-30)21-9-11-22(29)12-10-21/h2-3,5-12,15H,4,13-14,16-19H2,1H3/b20-5-