N-[(1R)-1-(1-adamantyl)ethyl]-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-nitro-pyridin-1-ium-2-amine Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-nitro-pyridin-1-ium-2-amine CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-nitro-2-pyridin-1-iumamine IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-nitropyridin-1-ium-2-amine Traditional Name: [(1R)-1-(1-adamantyl)ethyl]-(3-nitropyridin-1-ium-2-yl)amine Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC=[NH+]4)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC=[NH+]4)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O2/c1-11(19-16-15(20(21)22)3-2-4-18-16)17-8-12-5-13(9-17)7-14(6-12)10-17/h2-4,11-14H,5-10H2,1H3,(H,18,19)/p+1/t11-,12?,13?,14?,17?/m1/s1