N-[(3-methoxy-4-propoxy-phenyl)methyl]cycloheptanamine

Systemtic Name: N-[(3-methoxy-4-propoxy-phenyl)methyl]cycloheptanamine Openeye Name: N-[(3-methoxy-4-propoxy-phenyl)methyl]cycloheptanamine CAS Name: N-[(3-methoxy-4-propoxyphenyl)methyl]cycloheptanamine IUPAC Name: N-[(3-methoxy-4-propoxyphenyl)methyl]cycloheptanamine Traditional Name: cycloheptyl-(3-methoxy-4-propoxy-benzyl)amine Formula: C18H29NO2 MolecularWeight: 291.42836

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CNC2CCCCCC2)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CNC2CCCCCC2)OC

InChI

InChI=1S/C18H29NO2/c1-3-12-21-17-11-10-15(13-18(17)20-2)14-19-16-8-6-4-5-7-9-16/h10-11,13,16,19H,3-9,12,14H2,1-2H3