diethyl [(1S,4R)-4-[(4-methoxyphenyl)methyl-(4-phenylbut-3-ynyl)amino]cyclohex-2-en-1-yl] phosphate

Systemtic Name: diethyl [(1S,4R)-4-[(4-methoxyphenyl)methyl-(4-phenylbut-3-ynyl)amino]cyclohex-2-en-1-yl] phosphate Openeye Name: diethyl [(1S,4R)-4-[(4-methoxyphenyl)methyl-(4-phenylbut-3-ynyl)amino]cyclohex-2-en-1-yl] phosphate CAS Name: phosphoric acid diethyl [(1S,4R)-4-[(4-methoxyphenyl)methyl-(4-phenylbut-3-ynyl)amino]-1-cyclohex-2-enyl] ester IUPAC Name: diethyl [(1S,4R)-4-[(4-methoxyphenyl)methyl-(4-phenylbut-3-ynyl)amino]cyclohex-2-en-1-yl] phosphate Traditional Name: phosphoric acid diethyl [(1S,4R)-4-[p-anisyl(4-phenylbut-3-ynyl)amino]cyclohex-2-en-1-yl] ester Formula: C28H36NO5P MolecularWeight: 497.562901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1CCC(C=C1)N(CCC#CC2=CC=CC=C2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOP(=O)(OCC)O[C@H]1CC[C@H](C=C1)N(CCC#CC2=CC=CC=C2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C28H36NO5P/c1-4-32-35(30,33-5-2)34-28-20-16-26(17-21-28)29(23-25-14-18-27(31-3)19-15-25)22-10-9-13-24-11-7-6-8-12-24/h6-8,11-12,14-16,18-20,26,28H,4-5,10,17,21-23H2,1-3H3/t26-,28+/m0/s1