(2S)-2-azanyl-3-phenyl-propanoic acid; dicyclohexylazanium

Systemtic Name: (2S)-2-azanyl-3-phenyl-propanoic acid; dicyclohexylazanium Openeye Name: (2S)-2-amino-3-phenyl-propanoic acid; dicyclohexylammonium CAS Name: (2S)-2-amino-3-phenylpropanoic acid; dicyclohexylammonium IUPAC Name: (2S)-2-amino-3-phenylpropanoic acid; dicyclohexylazanium Traditional Name: (2S)-2-amino-3-phenyl-propionic acid; dicyclohexylammonium Formula: C21H35N2O2+ MolecularWeight: 347.5148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH2+]C2CCCCC2.C1=CC=C(C=C1)CC(C(=O)O)N

Isomeric SMILES

C1CCC(CC1)[NH2+]C2CCCCC2.C1=CC=C(C=C1)C[C@@H](C(=O)O)N

InChI

InChI=1S/C12H23N.C9H11NO2/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;10-8(9(11)12)6-7-4-2-1-3-5-7/h11-13H,1-10H2;1-5,8H,6,10H2,(H,11,12)/p+1/t;8-/m.0/s1