2-[(1S)-1-morpholin-4-yl-3-phenyl-prop-2-ynyl]-6-nitro-phenolate

Systemtic Name: 2-[(1S)-1-morpholin-4-yl-3-phenyl-prop-2-ynyl]-6-nitro-phenolate Openeye Name: 2-[(1S)-1-morpholino-3-phenyl-prop-2-ynyl]-6-nitro-phenolate CAS Name: 2-[(1S)-1-(4-morpholinyl)-3-phenylprop-2-ynyl]-6-nitrophenolate IUPAC Name: 2-[(1S)-1-morpholin-4-yl-3-phenylprop-2-ynyl]-6-nitrophenolate Traditional Name: 2-[(1S)-1-morpholino-3-phenyl-prop-2-ynyl]-6-nitro-phenolate Formula: C19H17N2O4- MolecularWeight: 337.34928

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(C#CC2=CC=CC=C2)C3=C(C(=CC=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1COCCN1[C@@H](C#CC2=CC=CC=C2)C3=C(C(=CC=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H18N2O4/c22-19-16(7-4-8-18(19)21(23)24)17(20-11-13-25-14-12-20)10-9-15-5-2-1-3-6-15/h1-8,17,22H,11-14H2/p-1/t17-/m0/s1