2-[2-[3-(1-adamantyl)-4-propan-2-yloxy-phenyl]ethyl]-2-azanyl-propane-1,3-diol

Systemtic Name: 2-[2-[3-(1-adamantyl)-4-propan-2-yloxy-phenyl]ethyl]-2-azanyl-propane-1,3-diol Openeye Name: 2-[2-[3-(1-adamantyl)-4-isopropoxy-phenyl]ethyl]-2-amino-propane-1,3-diol CAS Name: 2-[2-[3-(1-adamantyl)-4-propan-2-yloxyphenyl]ethyl]-2-aminopropane-1,3-diol IUPAC Name: 2-[2-[3-(1-adamantyl)-4-propan-2-yloxyphenyl]ethyl]-2-aminopropane-1,3-diol Traditional Name: 2-[2-[3-(1-adamantyl)-4-isopropoxy-phenyl]ethyl]-2-amino-propane-1,3-diol Formula: C24H37NO3 MolecularWeight: 387.55548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CCC(CO)(CO)N)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CCC(CO)(CO)N)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H37NO3/c1-16(2)28-22-4-3-17(5-6-24(25,14-26)15-27)10-21(22)23-11-18-7-19(12-23)9-20(8-18)13-23/h3-4,10,16,18-20,26-27H,5-9,11-15,25H2,1-2H3