[1-[3,5-bis(fluoranyl)phenyl]-4-[(3-ethylphenyl)methylamino]-3-oxidanyl-butan-2-yl]carbamoyl N-[4,4-bis(fluoranyl)octyl]carbamate

Systemtic Name: [1-[3,5-bis(fluoranyl)phenyl]-4-[(3-ethylphenyl)methylamino]-3-oxidanyl-butan-2-yl]carbamoyl N-[4,4-bis(fluoranyl)octyl]carbamate Openeye Name: [1-[(3,5-difluorophenyl)methyl]-3-[(3-ethylphenyl)methylamino]-2-hydroxy-propyl]carbamoyl N-(4,4-difluorooctyl)carbamate CAS Name: N-(4,4-difluorooctyl)carbamic acid [[[1-(3,5-difluorophenyl)-4-[(3-ethylphenyl)methylamino]-3-hydroxybutan-2-yl]amino]-oxomethyl] ester IUPAC Name: [1-(3,5-difluorophenyl)-4-[(3-ethylphenyl)methylamino]-3-hydroxybutan-2-yl]carbamoyl N-(4,4-difluorooctyl)carbamate Traditional Name: N-[1-(3,5-difluorobenzyl)-3-[(3-ethylbenzyl)amino]-2-hydroxy-propyl]carbamic acid 4,4-difluorooctylcarbamoyl ester Formula: C29H39F4N3O4 MolecularWeight: 569.631273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCNC(=O)OC(=O)NC(CC1=CC(=CC(=C1)F)F)C(CNCC2=CC=CC(=C2)CC)O)(F)F

Isomeric SMILES

CCCCC(CCCNC(=O)OC(=O)NC(CC1=CC(=CC(=C1)F)F)C(CNCC2=CC=CC(=C2)CC)O)(F)F

InChI

InChI=1S/C29H39F4N3O4/c1-3-5-10-29(32,33)11-7-12-35-27(38)40-28(39)36-25(16-22-14-23(30)17-24(31)15-22)26(37)19-34-18-21-9-6-8-20(4-2)13-21/h6,8-9,13-15,17,25-26,34,37H,3-5,7,10-12,16,18-19H2,1-2H3,(H,35,38)(H,36,39)