methyl 4-[4-(1-azanyl-3-cyclohexyl-propyl)phenyl]butanoate

Systemtic Name: methyl 4-[4-(1-azanyl-3-cyclohexyl-propyl)phenyl]butanoate Openeye Name: methyl 4-[4-(1-amino-3-cyclohexyl-propyl)phenyl]butanoate CAS Name: 4-[4-(1-amino-3-cyclohexylpropyl)phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(1-amino-3-cyclohexylpropyl)phenyl]butanoate Traditional Name: 4-[4-(1-amino-3-cyclohexyl-propyl)phenyl]butyric acid methyl ester Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(CCC2CCCCC2)N

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(CCC2CCCCC2)N

InChI

InChI=1S/C20H31NO2/c1-23-20(22)9-5-8-17-10-13-18(14-11-17)19(21)15-12-16-6-3-2-4-7-16/h10-11,13-14,16,19H,2-9,12,15,21H2,1H3