4,6-bis(chloranyl)-1-(3-cyclopentyloxy-4-methoxy-phenyl)-1-pyridin-4-yl-heptadecan-3-one

Systemtic Name: 4,6-bis(chloranyl)-1-(3-cyclopentyloxy-4-methoxy-phenyl)-1-pyridin-4-yl-heptadecan-3-one Openeye Name: 4,6-dichloro-1-[3-(cyclopentoxy)-4-methoxy-phenyl]-1-(4-pyridyl)heptadecan-3-one CAS Name: 4,6-dichloro-1-(3-cyclopentyloxy-4-methoxyphenyl)-1-pyridin-4-yl-3-heptadecanone IUPAC Name: 4,6-dichloro-1-(3-cyclopentyloxy-4-methoxyphenyl)-1-pyridin-4-ylheptadecan-3-one Traditional Name: 4,6-dichloro-1-[3-(cyclopentoxy)-4-methoxy-phenyl]-1-(4-pyridyl)heptadecan-3-one Formula: C34H49Cl2NO3 MolecularWeight: 590.66376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(C(=O)CC(C1=CC=NC=C1)C2=CC(=C(C=C2)OC)OC3CCCC3)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCC(CC(C(=O)CC(C1=CC=NC=C1)C2=CC(=C(C=C2)OC)OC3CCCC3)Cl)Cl

InChI

InChI=1S/C34H49Cl2NO3/c1-3-4-5-6-7-8-9-10-11-14-28(35)24-31(36)32(38)25-30(26-19-21-37-22-20-26)27-17-18-33(39-2)34(23-27)40-29-15-12-13-16-29/h17-23,28-31H,3-16,24-25H2,1-2H3