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

Systemtic Name: 2-[(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,6-dimethyl-phenolate Openeye Name: 2-[(3-chloro-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,6-dimethyl-phenolate CAS Name: 2-[(3-chloro-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4,6-dimethylphenolate IUPAC Name: 2-[(3-chloro-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4,6-dimethylphenolate Traditional Name: 2-[(3-chloro-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,6-dimethyl-phenolate Formula: C15H12ClN2O4- MolecularWeight: 319.71978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl)[O-])C

InChI

InChI=1S/C15H13ClN2O4/c1-8-3-9(2)14(19)12(4-8)17-7-10-5-11(16)6-13(15(10)20)18(21)22/h3-7,17,19H,1-2H3/p-1