[1-cyclohexyl-2-(1,4,5,6-tetrahydropyrimidin-2-ylamino)ethyl] 2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [1-cyclohexyl-2-(1,4,5,6-tetrahydropyrimidin-2-ylamino)ethyl] 2-oxidanyl-2-phenyl-ethanoate Openeye Name: [1-cyclohexyl-2-(1,4,5,6-tetrahydropyrimidin-2-ylamino)ethyl] 2-hydroxy-2-phenyl-acetate CAS Name: 2-hydroxy-2-phenylacetic acid [1-cyclohexyl-2-(1,4,5,6-tetrahydropyrimidin-2-ylamino)ethyl] ester IUPAC Name: [1-cyclohexyl-2-(1,4,5,6-tetrahydropyrimidin-2-ylamino)ethyl] 2-hydroxy-2-phenylacetate Traditional Name: 2-hydroxy-2-phenyl-acetic acid [1-cyclohexyl-2-(1,4,5,6-tetrahydropyrimidin-2-ylamino)ethyl] ester Formula: C20H29N3O3 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CNC2=NCCCN2)OC(=O)C(C3=CC=CC=C3)O

Isomeric SMILES

C1CCC(CC1)C(CNC2=NCCCN2)OC(=O)C(C3=CC=CC=C3)O

InChI

InChI=1S/C20H29N3O3/c24-18(16-10-5-2-6-11-16)19(25)26-17(15-8-3-1-4-9-15)14-23-20-21-12-7-13-22-20/h2,5-6,10-11,15,17-18,24H,1,3-4,7-9,12-14H2,(H2,21,22,23)