4-(4-chlorophenyl)-1-[(3Z)-3-(7-prop-2-ynoxy-6H-[1]benzoxepino[2,3-b]pyridin-5-ylidene)propyl]piperidin-4-ol

Systemtic Name: 4-(4-chlorophenyl)-1-[(3Z)-3-(7-prop-2-ynoxy-6H-[1]benzoxepino[2,3-b]pyridin-5-ylidene)propyl]piperidin-4-ol Openeye Name: 4-(4-chlorophenyl)-1-[(3Z)-3-(7-prop-2-ynoxy-6H-[1]benzoxepino[2,3-b]pyridin-5-ylidene)propyl]piperidin-4-ol CAS Name: 4-(4-chlorophenyl)-1-[(3Z)-3-(7-prop-2-ynoxy-6H-[1]benzoxepino[2,3-b]pyridin-5-ylidene)propyl]-4-piperidinol IUPAC Name: 4-(4-chlorophenyl)-1-[(3Z)-3-(7-prop-2-ynoxy-6H-[1]benzoxepino[2,3-b]pyridin-5-ylidene)propyl]piperidin-4-ol Traditional Name: 4-(4-chlorophenyl)-1-[(3Z)-3-(7-propargyloxy-6H-[1]benzoxepino[2,3-b]pyridin-5-ylidene)propyl]piperidin-4-ol Formula: C30H29ClN2O3 MolecularWeight: 501.01586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC2=C1CC(=CCCN3CCC(CC3)(C4=CC=C(C=C4)Cl)O)C5=C(O2)N=CC=C5

Isomeric SMILES

C#CCOC1=CC=CC2=C1C/C(=C/CCN3CCC(CC3)(C4=CC=C(C=C4)Cl)O)/C5=C(O2)N=CC=C5

InChI

InChI=1S/C30H29ClN2O3/c1-2-20-35-27-8-3-9-28-26(27)21-22(25-7-4-16-32-29(25)36-28)6-5-17-33-18-14-30(34,15-19-33)23-10-12-24(31)13-11-23/h1,3-4,6-13,16,34H,5,14-15,17-21H2/b22-6-