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

Systemtic Name: 2-[(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,6-dimethyl-phenolate Openeye Name: 2-[(5-methoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,6-dimethyl-phenolate CAS Name: 2-[(5-methoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4,6-dimethylphenolate IUPAC Name: 2-[(5-methoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4,6-dimethylphenolate Traditional Name: 2-[(6-keto-5-methoxy-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,6-dimethyl-phenolate Formula: C16H15N2O5- MolecularWeight: 315.3007

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O5/c1-9-4-10(2)15(19)13(5-9)17-8-11-6-12(18(21)22)7-14(23-3)16(11)20/h4-8,17,19H,1-3H3/p-1