(3S)-3-(2-cyclohexylethanoylamino)-3-phenyl-propanoate

Systemtic Name: (3S)-3-(2-cyclohexylethanoylamino)-3-phenyl-propanoate Openeye Name: (3S)-3-[(2-cyclohexylacetyl)amino]-3-phenyl-propanoate CAS Name: (3S)-3-[(2-cyclohexyl-1-oxoethyl)amino]-3-phenylpropanoate IUPAC Name: (3S)-3-[(2-cyclohexylacetyl)amino]-3-phenylpropanoate Traditional Name: (3S)-3-[(2-cyclohexylacetyl)amino]-3-phenyl-propionate Formula: C17H22NO3- MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NC(CC(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)CC(=O)N[C@@H](CC(=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C17H23NO3/c19-16(11-13-7-3-1-4-8-13)18-15(12-17(20)21)14-9-5-2-6-10-14/h2,5-6,9-10,13,15H,1,3-4,7-8,11-12H2,(H,18,19)(H,20,21)/p-1/t15-/m0/s1