[(1S,2S,3R,4S)-2-(diethylaminomethyl)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] N-(2-hexoxyphenyl)carbamate

Systemtic Name: [(1S,2S,3R,4S)-2-(diethylaminomethyl)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] N-(2-hexoxyphenyl)carbamate Openeye Name: [(1S,2R,3S,4S)-3-(diethylaminomethyl)-1,7,7-trimethyl-norbornan-2-yl] N-(2-hexoxyphenyl)carbamate CAS Name: N-(2-hexoxyphenyl)carbamic acid [(1S,2S,3R,4S)-2-(diethylaminomethyl)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester IUPAC Name: [(1S,2S,3R,4S)-2-(diethylaminomethyl)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] N-(2-hexoxyphenyl)carbamate Traditional Name: N-(2-hexoxyphenyl)carbamic acid [(1S,2R,3S,4S)-3-(diethylaminomethyl)-1,7,7-trimethyl-norbornan-2-yl] ester Formula: C28H46N2O3 MolecularWeight: 458.67644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1NC(=O)OC2C(C3CCC2(C3(C)C)C)CN(CC)CC

Isomeric SMILES

CCCCCCOC1=CC=CC=C1NC(=O)O[C@@H]2[C@@H]([C@@H]3CC[C@]2(C3(C)C)C)CN(CC)CC

InChI

InChI=1S/C28H46N2O3/c1-7-10-11-14-19-32-24-16-13-12-15-23(24)29-26(31)33-25-21(20-30(8-2)9-3)22-17-18-28(25,6)27(22,4)5/h12-13,15-16,21-22,25H,7-11,14,17-20H2,1-6H3,(H,29,31)/t21-,22+,25-,28-/m1/s1