4-[(Z)-2-(azaniumylmethyl)-3-(diethylamino)-3-oxidanylidene-prop-1-enyl]-2-nitro-6-oxidanyl-phenolate

Systemtic Name: 4-[(Z)-2-(azaniumylmethyl)-3-(diethylamino)-3-oxidanylidene-prop-1-enyl]-2-nitro-6-oxidanyl-phenolate Openeye Name: 4-[(Z)-2-(azaniumylmethyl)-3-(diethylamino)-3-oxo-prop-1-enyl]-2-hydroxy-6-nitro-phenolate CAS Name: 4-[(Z)-2-(ammoniomethyl)-3-(diethylamino)-3-oxoprop-1-enyl]-2-hydroxy-6-nitrophenolate IUPAC Name: 4-[(Z)-2-(azaniumylmethyl)-3-(diethylamino)-3-oxoprop-1-enyl]-2-hydroxy-6-nitrophenolate Traditional Name: 4-[(Z)-2-(ammoniomethyl)-3-(diethylamino)-3-keto-prop-1-enyl]-2-hydroxy-6-nitro-phenolate Formula: C14H19N3O5 MolecularWeight: 309.31776

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(=CC1=CC(=C(C(=C1)O)[O-])[N+](=O)[O-])C[NH3+]

Isomeric SMILES

CCN(CC)C(=O)/C(=C\C1=CC(=C(C(=C1)O)[O-])[N+](=O)[O-])/C[NH3+]

InChI

InChI=1S/C14H19N3O5/c1-3-16(4-2)14(20)10(8-15)5-9-6-11(17(21)22)13(19)12(18)7-9/h5-7,18-19H,3-4,8,15H2,1-2H3/b10-5-