N-cyclohexylcyclohexanamine; (2S)-2-(ethenoxycarbonylamino)-3-phenyl-propanoic acid

Systemtic Name: N-cyclohexylcyclohexanamine; (2S)-2-(ethenoxycarbonylamino)-3-phenyl-propanoic acid Openeye Name: N-cyclohexylcyclohexanamine; (2S)-3-phenyl-2-(vinyloxycarbonylamino)propanoic acid CAS Name: N-cyclohexylcyclohexanamine; (2S)-2-[[ethenoxy(oxo)methyl]amino]-3-phenylpropanoic acid IUPAC Name: N-cyclohexylcyclohexanamine; (2S)-2-(ethenoxycarbonylamino)-3-phenylpropanoic acid Traditional Name: dicyclohexylamine; (2S)-3-phenyl-2-(vinyloxycarbonylamino)propionic acid Formula: C24H36N2O4 MolecularWeight: 416.55364

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Descriptors Computed from Structure

Canonical SMILES:

C=COC(=O)NC(CC1=CC=CC=C1)C(=O)O.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

C=COC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C12H13NO4.C12H23N/c1-2-17-12(16)13-10(11(14)15)8-9-6-4-3-5-7-9;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h2-7,10H,1,8H2,(H,13,16)(H,14,15);11-13H,1-10H2/t10-;/m0./s1