3-[4-[1-(1-azanylethyl)cyclohexyl]carbonyloxyphenyl]propanoic acid

Systemtic Name: 3-[4-[1-(1-azanylethyl)cyclohexyl]carbonyloxyphenyl]propanoic acid Openeye Name: 3-[4-[1-(1-aminoethyl)cyclohexanecarbonyl]oxyphenyl]propanoic acid CAS Name: 3-[4-[[1-(1-aminoethyl)cyclohexyl]-oxomethoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[1-(1-aminoethyl)cyclohexanecarbonyl]oxyphenyl]propanoic acid Traditional Name: 3-[4-[1-(1-aminoethyl)cyclohexanecarbonyl]oxyphenyl]propionic acid Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CCCCC1)C(=O)OC2=CC=C(C=C2)CCC(=O)O)N

Isomeric SMILES

CC(C1(CCCCC1)C(=O)OC2=CC=C(C=C2)CCC(=O)O)N

InChI

InChI=1S/C18H25NO4/c1-13(19)18(11-3-2-4-12-18)17(22)23-15-8-5-14(6-9-15)7-10-16(20)21/h5-6,8-9,13H,2-4,7,10-12,19H2,1H3,(H,20,21)