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3-(1-adamantylamino)-2-nitro-3-oxidanylidene-propanoic acid

3-(1-adamantylamino)-2-nitro-3-oxidanylidene-propanoic acid

Systemtic Name:3-(1-adamantylamino)-2-nitro-3-oxidanylidene-propanoic acid
Openeye Name:3-(1-adamantylamino)-2-nitro-3-oxo-propanoic acid
CAS Name:3-(1-adamantylamino)-2-nitro-3-oxopropanoic acid
IUPAC Name:3-(1-adamantylamino)-2-nitro-3-oxopropanoic acid
Traditional Name:3-(1-adamantylamino)-3-keto-2-nitro-propionic acid
Formula: C13H18N2O5
MolecularWeight: 282.29242
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C(C(=O)O)[N+](=O)[O-]


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C(C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C13H18N2O5/c16-11(10(12(17)18)15(19)20)14-13-4-7-1-8(5-13)3-9(2-7)6-13/h7-10H,1-6H2,(H,14,16)(H,17,18)


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