2-ethoxy-4-nitro-6-[(E)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenolate

Systemtic Name: 2-ethoxy-4-nitro-6-[(E)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenolate Openeye Name: 2-[(E)-(2-anilino-4-oxo-thiazol-5-ylidene)methyl]-6-ethoxy-4-nitro-phenolate CAS Name: 2-[(E)-(2-anilino-4-oxo-5-thiazolylidene)methyl]-6-ethoxy-4-nitrophenolate IUPAC Name: 2-[(E)-(2-anilino-4-oxo-1,3-thiazol-5-ylidene)methyl]-6-ethoxy-4-nitrophenolate Traditional Name: 2-[(E)-(2-anilino-4-keto-2-thiazolin-5-ylidene)methyl]-6-ethoxy-4-nitro-phenolate Formula: C18H14N3O5S- MolecularWeight: 384.38586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=C2C(=O)N=C(S2)NC3=CC=CC=C3)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])/C=C/2\C(=O)N=C(S2)NC3=CC=CC=C3)[O-]

InChI

InChI=1S/C18H15N3O5S/c1-2-26-14-10-13(21(24)25)8-11(16(14)22)9-15-17(23)20-18(27-15)19-12-6-4-3-5-7-12/h3-10,22H,2H2,1H3,(H,19,20,23)/p-1/b15-9+