N-[[4-(3-methylbutyl)phenyl]methyl]cycloheptanamine

Systemtic Name: N-[[4-(3-methylbutyl)phenyl]methyl]cycloheptanamine Openeye Name: N-[(4-isopentylphenyl)methyl]cycloheptanamine CAS Name: N-[[4-(3-methylbutyl)phenyl]methyl]cycloheptanamine IUPAC Name: N-[[4-(3-methylbutyl)phenyl]methyl]cycloheptanamine Traditional Name: cycloheptyl-(4-isoamylbenzyl)amine Formula: C19H31N MolecularWeight: 273.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC=C(C=C1)CNC2CCCCCC2

Isomeric SMILES

CC(C)CCC1=CC=C(C=C1)CNC2CCCCCC2

InChI

InChI=1S/C19H31N/c1-16(2)9-10-17-11-13-18(14-12-17)15-20-19-7-5-3-4-6-8-19/h11-14,16,19-20H,3-10,15H2,1-2H3