methyl 4-[4-(1-azanyl-5-cyclohexyl-pentyl)phenyl]butanoate

Systemtic Name: methyl 4-[4-(1-azanyl-5-cyclohexyl-pentyl)phenyl]butanoate Openeye Name: methyl 4-[4-(1-amino-5-cyclohexyl-pentyl)phenyl]butanoate CAS Name: 4-[4-(1-amino-5-cyclohexylpentyl)phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(1-amino-5-cyclohexylpentyl)phenyl]butanoate Traditional Name: 4-[4-(1-amino-5-cyclohexyl-pentyl)phenyl]butyric acid methyl ester Formula: C22H35NO2 MolecularWeight: 345.5188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(CCCCC2CCCCC2)N

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(CCCCC2CCCCC2)N

InChI

InChI=1S/C22H35NO2/c1-25-22(24)13-7-11-19-14-16-20(17-15-19)21(23)12-6-5-10-18-8-3-2-4-9-18/h14-18,21H,2-13,23H2,1H3