[1-[8-[bis(pyridin-2-ylmethyl)amino]octyl]-4-methyl-piperidin-4-yl] N-(2-phenylphenyl)carbamate

Systemtic Name: [1-[8-[bis(pyridin-2-ylmethyl)amino]octyl]-4-methyl-piperidin-4-yl] N-(2-phenylphenyl)carbamate Openeye Name: [1-[8-[bis(2-pyridylmethyl)amino]octyl]-4-methyl-4-piperidyl] N-(2-phenylphenyl)carbamate CAS Name: N-(2-phenylphenyl)carbamic acid [1-[8-[bis(2-pyridinylmethyl)amino]octyl]-4-methyl-4-piperidinyl] ester IUPAC Name: [1-[8-[bis(pyridin-2-ylmethyl)amino]octyl]-4-methylpiperidin-4-yl] N-(2-phenylphenyl)carbamate Traditional Name: N-(2-phenylphenyl)carbamic acid [1-[8-[bis(2-pyridylmethyl)amino]octyl]-4-methyl-4-piperidyl] ester Formula: C39H49N5O2 MolecularWeight: 619.83866

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)CCCCCCCCN(CC2=CC=CC=N2)CC3=CC=CC=N3)OC(=O)NC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

CC1(CCN(CC1)CCCCCCCCN(CC2=CC=CC=N2)CC3=CC=CC=N3)OC(=O)NC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C39H49N5O2/c1-39(46-38(45)42-37-22-10-9-21-36(37)33-17-7-6-8-18-33)23-29-43(30-24-39)27-15-4-2-3-5-16-28-44(31-34-19-11-13-25-40-34)32-35-20-12-14-26-41-35/h6-14,17-22,25-26H,2-5,15-16,23-24,27-32H2,1H3,(H,42,45)