dicyclohexylazanium; 2-(methoxycarbonylamino)-3-phenyl-propanoic acid

Systemtic Name: dicyclohexylazanium; 2-(methoxycarbonylamino)-3-phenyl-propanoic acid Openeye Name: dicyclohexylammonium; 2-(methoxycarbonylamino)-3-phenyl-propanoic acid CAS Name: dicyclohexylammonium; 2-(methoxycarbonylamino)-3-phenylpropanoic acid IUPAC Name: dicyclohexylazanium; 2-(methoxycarbonylamino)-3-phenylpropanoic acid Traditional Name: 2-(carbomethoxyamino)-3-phenyl-propionic acid; dicyclohexylammonium Formula: C23H37N2O4+ MolecularWeight: 405.55088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23N.C11H13NO4/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-16-11(15)12-9(10(13)14)7-8-5-3-2-4-6-8/h11-13H,1-10H2;2-6,9H,7H2,1H3,(H,12,15)(H,13,14)/p+1