[bis[(5-methyl-2-propan-2-yl-cyclohexyl)oxy]phosphoryl-(4-bromophenyl)methyl] 2-naphthalen-1-yloxyethanoate

Systemtic Name: [bis[(5-methyl-2-propan-2-yl-cyclohexyl)oxy]phosphoryl-(4-bromophenyl)methyl] 2-naphthalen-1-yloxyethanoate Openeye Name: [bis(2-isopropyl-5-methyl-cyclohexoxy)phosphoryl-(4-bromophenyl)methyl] 2-(1-naphthyloxy)acetate CAS Name: 2-(1-naphthalenyloxy)acetic acid [bis[(5-methyl-2-propan-2-ylcyclohexyl)oxy]phosphoryl-(4-bromophenyl)methyl] ester IUPAC Name: [bis[(5-methyl-2-propan-2-ylcyclohexyl)oxy]phosphoryl-(4-bromophenyl)methyl] 2-naphthalen-1-yloxyacetate Traditional Name: 2-(1-naphthoxy)acetic acid [bis(2-isopropyl-5-methyl-cyclohexoxy)phosphoryl-(4-bromophenyl)methyl] ester Formula: C39H52BrO6P MolecularWeight: 727.704341

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OP(=O)(C(C2=CC=C(C=C2)Br)OC(=O)COC3=CC=CC4=CC=CC=C43)OC5CC(CCC5C(C)C)C)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OP(=O)(C(C2=CC=C(C=C2)Br)OC(=O)COC3=CC=CC4=CC=CC=C43)OC5CC(CCC5C(C)C)C)C(C)C

InChI

InChI=1S/C39H52BrO6P/c1-25(2)32-20-14-27(5)22-36(32)45-47(42,46-37-23-28(6)15-21-33(37)26(3)4)39(30-16-18-31(40)19-17-30)44-38(41)24-43-35-13-9-11-29-10-7-8-12-34(29)35/h7-13,16-19,25-28,32-33,36-37,39H,14-15,20-24H2,1-6H3