2-[[(1S)-1-(3,4-diethoxyphenyl)ethyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[(1S)-1-(3,4-diethoxyphenyl)ethyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[(1S)-1-(3,4-diethoxyphenyl)ethyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[(1S)-1-(3,4-diethoxyphenyl)ethyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[(1S)-1-(3,4-diethoxyphenyl)ethyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[(1S)-1-(3,4-diethoxyphenyl)ethyl]iminomethyl]-4-nitro-phenolate Formula: C19H21N2O5- MolecularWeight: 357.38044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])OCC

InChI

InChI=1S/C19H22N2O5/c1-4-25-18-9-6-14(11-19(18)26-5-2)13(3)20-12-15-10-16(21(23)24)7-8-17(15)22/h6-13,22H,4-5H2,1-3H3/p-1/t13-/m0/s1