cycloheptyl-[(3-phenylmethoxyphenyl)methyl]azanium

Systemtic Name: cycloheptyl-[(3-phenylmethoxyphenyl)methyl]azanium Openeye Name: (3-benzyloxyphenyl)methyl-cycloheptyl-ammonium CAS Name: cycloheptyl-[(3-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: cycloheptyl-[(3-phenylmethoxyphenyl)methyl]azanium Traditional Name: (3-benzoxybenzyl)-cycloheptyl-ammonium Formula: C21H28NO+ MolecularWeight: 310.45312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH2+]CC2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1CCCC(CC1)[NH2+]CC2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H27NO/c1-2-7-13-20(12-6-1)22-16-19-11-8-14-21(15-19)23-17-18-9-4-3-5-10-18/h3-5,8-11,14-15,20,22H,1-2,6-7,12-13,16-17H2/p+1