2-[[[4-(diethylamino)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[[4-(diethylamino)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[4-(diethylamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]methylamino]methyl]-4-nitro-phenolate CAS Name: 2-[[[4-(diethylamino)-6-oxo-1-cyclohexa-2,4-dienylidene]methylamino]methyl]-4-nitrophenolate IUPAC Name: 2-[[[4-(diethylamino)-6-oxocyclohexa-2,4-dien-1-ylidene]methylamino]methyl]-4-nitrophenolate Traditional Name: 2-[[[4-(diethylamino)-6-keto-cyclohexa-2,4-dien-1-ylidene]methylamino]methyl]-4-nitro-phenolate Formula: C18H20N3O4- MolecularWeight: 342.3691

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=O)C(=CNCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C=C1

Isomeric SMILES

CCN(CC)C1=CC(=O)C(=CNCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C=C1

InChI

InChI=1S/C18H21N3O4/c1-3-20(4-2)15-6-5-13(18(23)10-15)11-19-12-14-9-16(21(24)25)7-8-17(14)22/h5-11,19,22H,3-4,12H2,1-2H3/p-1