2-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-propyl-phenolate

Systemtic Name: 2-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-propyl-phenolate Openeye Name: 2-[(5-bromo-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-propyl-phenolate CAS Name: 2-[(5-bromo-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-propylphenolate IUPAC Name: 2-[(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4-propylphenolate Traditional Name: 2-[(5-bromo-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-propyl-phenolate Formula: C16H14BrN2O4- MolecularWeight: 378.19736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)[O-])NC=C2C=C(C=C(C2=O)Br)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=C(C=C1)[O-])NC=C2C=C(C=C(C2=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H15BrN2O4/c1-2-3-10-4-5-15(20)14(6-10)18-9-11-7-12(19(22)23)8-13(17)16(11)21/h4-9,18,20H,2-3H2,1H3/p-1