4-tert-butyl-2-chloranyl-6-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenolate

Systemtic Name: 4-tert-butyl-2-chloranyl-6-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenolate Openeye Name: 4-tert-butyl-2-chloro-6-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenolate CAS Name: 4-tert-butyl-2-chloro-6-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenolate IUPAC Name: 4-tert-butyl-2-chloro-6-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenolate Traditional Name: 4-tert-butyl-2-chloro-6-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]phenolate Formula: C17H16ClN2O4- MolecularWeight: 347.77294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)Cl)[O-])NC=C2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)Cl)[O-])NC=C2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O4/c1-17(2,3)11-7-13(18)16(22)14(8-11)19-9-10-6-12(20(23)24)4-5-15(10)21/h4-9,19,22H,1-3H3/p-1