[1-(2-but-2-ynylphenyl)-4-(diethylamino)cyclohexyl] 2-oxidanylethanoate

Systemtic Name: [1-(2-but-2-ynylphenyl)-4-(diethylamino)cyclohexyl] 2-oxidanylethanoate Openeye Name: [1-(2-but-2-ynylphenyl)-4-(diethylamino)cyclohexyl] 2-hydroxyacetate CAS Name: 2-hydroxyacetic acid [1-(2-but-2-ynylphenyl)-4-(diethylamino)cyclohexyl] ester IUPAC Name: [1-(2-but-2-ynylphenyl)-4-(diethylamino)cyclohexyl] 2-hydroxyacetate Traditional Name: 2-hydroxyacetic acid [1-(2-but-2-ynylphenyl)-4-(diethylamino)cyclohexyl] ester Formula: C22H31NO3 MolecularWeight: 357.48644

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1CCC(CC1)(C2=CC=CC=C2CC#CC)OC(=O)CO

Isomeric SMILES

CCN(CC)C1CCC(CC1)(C2=CC=CC=C2CC#CC)OC(=O)CO

InChI

InChI=1S/C22H31NO3/c1-4-7-10-18-11-8-9-12-20(18)22(26-21(25)17-24)15-13-19(14-16-22)23(5-2)6-3/h8-9,11-12,19,24H,5-6,10,13-17H2,1-3H3