cycloheptyl-[(3-ethoxy-4-phenylmethoxy-phenyl)methyl]azanium

Systemtic Name: cycloheptyl-[(3-ethoxy-4-phenylmethoxy-phenyl)methyl]azanium Openeye Name: (4-benzyloxy-3-ethoxy-phenyl)methyl-cycloheptyl-ammonium CAS Name: cycloheptyl-[(3-ethoxy-4-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: cycloheptyl-[(3-ethoxy-4-phenylmethoxyphenyl)methyl]azanium Traditional Name: (4-benzoxy-3-ethoxy-benzyl)-cycloheptyl-ammonium Formula: C23H32NO2+ MolecularWeight: 354.50568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C2CCCCCC2)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C2CCCCCC2)OCC3=CC=CC=C3

InChI

InChI=1S/C23H31NO2/c1-2-25-23-16-20(17-24-21-12-8-3-4-9-13-21)14-15-22(23)26-18-19-10-6-5-7-11-19/h5-7,10-11,14-16,21,24H,2-4,8-9,12-13,17-18H2,1H3/p+1