[(1R,3S,4S)-3-cyclohexyl-4-(hydroxymethyl)-3-phenyl-cyclopentyl] 2-azanylethanoate

Systemtic Name: [(1R,3S,4S)-3-cyclohexyl-4-(hydroxymethyl)-3-phenyl-cyclopentyl] 2-azanylethanoate Openeye Name: [(1R,3S,4S)-3-cyclohexyl-4-(hydroxymethyl)-3-phenyl-cyclopentyl] 2-aminoacetate CAS Name: 2-aminoacetic acid [(1R,3S,4S)-3-cyclohexyl-4-(hydroxymethyl)-3-phenylcyclopentyl] ester IUPAC Name: [(1R,3S,4S)-3-cyclohexyl-4-(hydroxymethyl)-3-phenylcyclopentyl] 2-aminoacetate Traditional Name: 2-aminoacetic acid [(1R,3S,4S)-3-cyclohexyl-4-methylol-3-phenyl-cyclopentyl] ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2(CC(CC2CO)OC(=O)CN)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)[C@]2(C[C@@H](C[C@@H]2CO)OC(=O)CN)C3=CC=CC=C3

InChI

InChI=1S/C20H29NO3/c21-13-19(23)24-18-11-17(14-22)20(12-18,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1,3-4,7-8,16-18,22H,2,5-6,9-14,21H2/t17-,18-,20+/m1/s1