4-chloranyl-2-[[(2R)-1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[[(2R)-1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl]iminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[[(1R)-1-methoxycarbonyl-3-methyl-butyl]iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[[(2R)-1-methoxy-4-methyl-1-oxopentan-2-yl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[[(2R)-1-methoxy-4-methyl-1-oxopentan-2-yl]iminomethyl]-6-nitrophenolate Traditional Name: 2-[[(1R)-1-carbomethoxy-3-methyl-butyl]iminomethyl]-4-chloro-6-nitro-phenolate Formula: C14H16ClN2O5- MolecularWeight: 327.74024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)N=CC1=CC(=CC(=C1[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)N=CC1=CC(=CC(=C1[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C14H17ClN2O5/c1-8(2)4-11(14(19)22-3)16-7-9-5-10(15)6-12(13(9)18)17(20)21/h5-8,11,18H,4H2,1-3H3/p-1/t11-/m1/s1