2-[[(1R)-1-(1-adamantyl)ethyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[(1R)-1-(1-adamantyl)ethyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[(1R)-1-(1-adamantyl)ethyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[(1R)-1-(1-adamantyl)ethyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[(1R)-1-(1-adamantyl)ethyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[(1R)-1-(1-adamantyl)ethyl]iminomethyl]-4-nitro-phenolate Formula: C19H23N2O3- MolecularWeight: 327.39752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)N=CC4=C(C=CC(=C4)[N+](=O)[O-])[O-]

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)N=CC4=C(C=CC(=C4)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H24N2O3/c1-12(19-8-13-4-14(9-19)6-15(5-13)10-19)20-11-16-7-17(21(23)24)2-3-18(16)22/h2-3,7,11-15,22H,4-6,8-10H2,1H3/p-1/t12-,13?,14?,15?,19?/m1/s1