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

Systemtic Name: N-[(3-chloranyl-5-methoxy-4-phenylmethoxy-phenyl)methyl]cycloheptanamine Openeye Name: N-[(4-benzyloxy-3-chloro-5-methoxy-phenyl)methyl]cycloheptanamine CAS Name: N-[(3-chloro-5-methoxy-4-phenylmethoxyphenyl)methyl]cycloheptanamine IUPAC Name: N-[(3-chloro-5-methoxy-4-phenylmethoxyphenyl)methyl]cycloheptanamine Traditional Name: (4-benzoxy-3-chloro-5-methoxy-benzyl)-cycloheptyl-amine Formula: C22H28ClNO2 MolecularWeight: 373.91622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2CCCCCC2)Cl)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2CCCCCC2)Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C22H28ClNO2/c1-25-21-14-18(15-24-19-11-7-2-3-8-12-19)13-20(23)22(21)26-16-17-9-5-4-6-10-17/h4-6,9-10,13-14,19,24H,2-3,7-8,11-12,15-16H2,1H3