(3-chloranyl-4-phenylmethoxy-phenyl)methyl-cyclooctyl-azanium

Systemtic Name: (3-chloranyl-4-phenylmethoxy-phenyl)methyl-cyclooctyl-azanium Openeye Name: (4-benzyloxy-3-chloro-phenyl)methyl-cyclooctyl-ammonium CAS Name: (3-chloro-4-phenylmethoxyphenyl)methyl-cyclooctylammonium IUPAC Name: (3-chloro-4-phenylmethoxyphenyl)methyl-cyclooctylazanium Traditional Name: (4-benzoxy-3-chloro-benzyl)-cyclooctyl-ammonium Formula: C22H29ClNO+ MolecularWeight: 358.92476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH2+]CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Cl

Isomeric SMILES

C1CCCC(CCC1)[NH2+]CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H28ClNO/c23-21-15-19(16-24-20-11-7-2-1-3-8-12-20)13-14-22(21)25-17-18-9-5-4-6-10-18/h4-6,9-10,13-15,20,24H,1-3,7-8,11-12,16-17H2/p+1