[4-[(3-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-cycloheptyl-azanium

Systemtic Name: [4-[(3-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-cycloheptyl-azanium Openeye Name: [4-[(3-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-cycloheptyl-ammonium CAS Name: [4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-cycloheptylammonium IUPAC Name: [4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-cycloheptylazanium Traditional Name: [4-(3-chlorobenzyl)oxy-3-methoxy-benzyl]-cycloheptyl-ammonium Formula: C22H29ClNO2+ MolecularWeight: 374.92416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]C2CCCCCC2)OCC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]C2CCCCCC2)OCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H28ClNO2/c1-25-22-14-17(15-24-20-9-4-2-3-5-10-20)11-12-21(22)26-16-18-7-6-8-19(23)13-18/h6-8,11-14,20,24H,2-5,9-10,15-16H2,1H3/p+1