[4-(phenylcarbonyl)cyclohexyl] 2-oxidanyl-3-(1-phenylpropan-2-ylamino)propanoate

Systemtic Name: [4-(phenylcarbonyl)cyclohexyl] 2-oxidanyl-3-(1-phenylpropan-2-ylamino)propanoate Openeye Name: (4-benzoylcyclohexyl) 2-hydroxy-3-[(1-methyl-2-phenyl-ethyl)amino]propanoate CAS Name: 2-hydroxy-3-(1-phenylpropan-2-ylamino)propanoic acid (4-benzoylcyclohexyl) ester IUPAC Name: (4-benzoylcyclohexyl) 2-hydroxy-3-(1-phenylpropan-2-ylamino)propanoate Traditional Name: 2-hydroxy-3-[(1-methyl-2-phenyl-ethyl)amino]propionic acid (4-benzoylcyclohexyl) ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)NCC(C(=O)OC2CCC(CC2)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC(CC1=CC=CC=C1)NCC(C(=O)OC2CCC(CC2)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C25H31NO4/c1-18(16-19-8-4-2-5-9-19)26-17-23(27)25(29)30-22-14-12-21(13-15-22)24(28)20-10-6-3-7-11-20/h2-11,18,21-23,26-27H,12-17H2,1H3