(2S)-2-(3-cyclohexylpropanoylamino)-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-(3-cyclohexylpropanoylamino)-3-oxidanyl-propanoate Openeye Name: (2S)-2-(3-cyclohexylpropanoylamino)-3-hydroxy-propanoate CAS Name: (2S)-2-[(3-cyclohexyl-1-oxopropyl)amino]-3-hydroxypropanoate IUPAC Name: (2S)-2-(3-cyclohexylpropanoylamino)-3-hydroxypropanoate Traditional Name: (2S)-2-(3-cyclohexylpropanoylamino)-3-hydroxy-propionate Formula: C12H20NO4- MolecularWeight: 242.2915

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)CCC(=O)N[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C12H21NO4/c14-8-10(12(16)17)13-11(15)7-6-9-4-2-1-3-5-9/h9-10,14H,1-8H2,(H,13,15)(H,16,17)/p-1/t10-/m0/s1