5-[[(1S)-1-(4-ethoxyphenyl)ethyl]carbamoyl]-2-nitro-phenolate

Systemtic Name: 5-[[(1S)-1-(4-ethoxyphenyl)ethyl]carbamoyl]-2-nitro-phenolate Openeye Name: 5-[[(1S)-1-(4-ethoxyphenyl)ethyl]carbamoyl]-2-nitro-phenolate CAS Name: 5-[[[(1S)-1-(4-ethoxyphenyl)ethyl]amino]-oxomethyl]-2-nitrophenolate IUPAC Name: 5-[[(1S)-1-(4-ethoxyphenyl)ethyl]carbamoyl]-2-nitrophenolate Traditional Name: 2-nitro-5-[[(1S)-1-p-phenetylethyl]carbamoyl]phenolate Formula: C17H17N2O5- MolecularWeight: 329.32728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5/c1-3-24-14-7-4-12(5-8-14)11(2)18-17(21)13-6-9-15(19(22)23)16(20)10-13/h4-11,20H,3H2,1-2H3,(H,18,21)/p-1/t11-/m0/s1