[(1R)-1-(1-adamantyl)ethyl]-[(3-ethoxyphenyl)methyl]azanium

Systemtic Name: [(1R)-1-(1-adamantyl)ethyl]-[(3-ethoxyphenyl)methyl]azanium Openeye Name: [(1R)-1-(1-adamantyl)ethyl]-[(3-ethoxyphenyl)methyl]ammonium CAS Name: [(1R)-1-(1-adamantyl)ethyl]-[(3-ethoxyphenyl)methyl]ammonium IUPAC Name: [(1R)-1-(1-adamantyl)ethyl]-[(3-ethoxyphenyl)methyl]azanium Traditional Name: [(1R)-1-(1-adamantyl)ethyl]-(3-ethoxybenzyl)ammonium Formula: C21H32NO+ MolecularWeight: 314.48488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C[NH2+]C(C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC1=CC=CC(=C1)C[NH2+][C@H](C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H31NO/c1-3-23-20-6-4-5-16(10-20)14-22-15(2)21-11-17-7-18(12-21)9-19(8-17)13-21/h4-6,10,15,17-19,22H,3,7-9,11-14H2,1-2H3/p+1/t15-,17?,18?,19?,21?/m1/s1