2-[2-(1-adamantylsulfanyl)ethyl-nitroso-amino]propanoic acid

Systemtic Name: 2-[2-(1-adamantylsulfanyl)ethyl-nitroso-amino]propanoic acid Openeye Name: 2-[2-(1-adamantylsulfanyl)ethyl-nitroso-amino]propanoic acid CAS Name: 2-[2-(1-adamantylthio)ethyl-nitrosoamino]propanoic acid IUPAC Name: 2-[2-(1-adamantylsulfanyl)ethyl-nitrosoamino]propanoic acid Traditional Name: 2-[2-(1-adamantylthio)ethyl-nitroso-amino]propionic acid Formula: C15H24N2O3S MolecularWeight: 312.42766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(CCSC12CC3CC(C1)CC(C3)C2)N=O

Isomeric SMILES

CC(C(=O)O)N(CCSC12CC3CC(C1)CC(C3)C2)N=O

InChI

InChI=1S/C15H24N2O3S/c1-10(14(18)19)17(16-20)2-3-21-15-7-11-4-12(8-15)6-13(5-11)9-15/h10-13H,2-9H2,1H3,(H,18,19)