[(1R,3S,4S)-3-(hydroxymethyl)-4-phenyl-cyclopentyl] 2-(cyclohexylamino)ethanoate

Systemtic Name: [(1R,3S,4S)-3-(hydroxymethyl)-4-phenyl-cyclopentyl] 2-(cyclohexylamino)ethanoate Openeye Name: [(1R,3S,4S)-3-(hydroxymethyl)-4-phenyl-cyclopentyl] 2-(cyclohexylamino)acetate CAS Name: 2-(cyclohexylamino)acetic acid [(1R,3S,4S)-3-(hydroxymethyl)-4-phenylcyclopentyl] ester IUPAC Name: [(1R,3S,4S)-3-(hydroxymethyl)-4-phenylcyclopentyl] 2-(cyclohexylamino)acetate Traditional Name: 2-(cyclohexylamino)acetic acid [(1R,3S,4S)-3-methylol-4-phenyl-cyclopentyl] ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCC(=O)OC2CC(C(C2)C3=CC=CC=C3)CO

Isomeric SMILES

C1CCC(CC1)NCC(=O)O[C@H]2C[C@@H]([C@H](C2)C3=CC=CC=C3)CO

InChI

InChI=1S/C20H29NO3/c22-14-16-11-18(12-19(16)15-7-3-1-4-8-15)24-20(23)13-21-17-9-5-2-6-10-17/h1,3-4,7-8,16-19,21-22H,2,5-6,9-14H2/t16-,18+,19-/m1/s1