2-methoxy-6-[(E)-[2-[(4-methylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-methoxy-6-[(E)-[2-[(4-methylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-4-nitro-phenolate Openeye Name: 2-methoxy-6-[(E)-[2-(4-methylanilino)-4-oxo-thiazol-5-ylidene]methyl]-4-nitro-phenolate CAS Name: 2-methoxy-6-[(E)-[2-(4-methylanilino)-4-oxo-5-thiazolylidene]methyl]-4-nitrophenolate IUPAC Name: 2-methoxy-6-[(E)-[2-(4-methylanilino)-4-oxo-1,3-thiazol-5-ylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(E)-[4-keto-2-(p-toluidino)-2-thiazolin-5-ylidene]methyl]-6-methoxy-4-nitro-phenolate Formula: C18H14N3O5S- MolecularWeight: 384.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=CC(=C3[O-])OC)[N+](=O)[O-])S2

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=O)/C(=C\C3=CC(=CC(=C3[O-])OC)[N+](=O)[O-])/S2

InChI

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