N-[[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]methyl]cycloheptanamine

Systemtic Name: N-[[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]methyl]cycloheptanamine Openeye Name: N-[(4-benzyloxy-3,5-dichloro-phenyl)methyl]cycloheptanamine CAS Name: N-[(3,5-dichloro-4-phenylmethoxyphenyl)methyl]cycloheptanamine IUPAC Name: N-[(3,5-dichloro-4-phenylmethoxyphenyl)methyl]cycloheptanamine Traditional Name: (4-benzoxy-3,5-dichloro-benzyl)-cycloheptyl-amine Formula: C21H25Cl2NO MolecularWeight: 378.3353

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NCC2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3)Cl

Isomeric SMILES

C1CCCC(CC1)NCC2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H25Cl2NO/c22-19-12-17(14-24-18-10-6-1-2-7-11-18)13-20(23)21(19)25-15-16-8-4-3-5-9-16/h3-5,8-9,12-13,18,24H,1-2,6-7,10-11,14-15H2