[2-[4-[4-(aminomethyl)cyclohexyl]carbonylphenyl]-1-oxidanyl-ethyl] ethanoate

Systemtic Name: [2-[4-[4-(aminomethyl)cyclohexyl]carbonylphenyl]-1-oxidanyl-ethyl] ethanoate Openeye Name: [2-[4-[4-(aminomethyl)cyclohexanecarbonyl]phenyl]-1-hydroxy-ethyl] acetate CAS Name: acetic acid [2-[4-[[4-(aminomethyl)cyclohexyl]-oxomethyl]phenyl]-1-hydroxyethyl] ester IUPAC Name: [2-[4-[4-(aminomethyl)cyclohexanecarbonyl]phenyl]-1-hydroxyethyl] acetate Traditional Name: acetic acid [2-[4-[4-(aminomethyl)cyclohexanecarbonyl]phenyl]-1-hydroxy-ethyl] ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC1=CC=C(C=C1)C(=O)C2CCC(CC2)CN)O

Isomeric SMILES

CC(=O)OC(CC1=CC=C(C=C1)C(=O)C2CCC(CC2)CN)O

InChI

InChI=1S/C18H25NO4/c1-12(20)23-17(21)10-13-2-6-15(7-3-13)18(22)16-8-4-14(11-19)5-9-16/h2-3,6-7,14,16-17,21H,4-5,8-11,19H2,1H3