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

Systemtic Name: 2-methoxy-4-[(E)-[2-(naphthalen-1-ylamino)-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-6-nitro-phenolate Openeye Name: 2-methoxy-4-[(E)-[2-(1-naphthylamino)-4-oxo-thiazol-5-ylidene]methyl]-6-nitro-phenolate CAS Name: 2-methoxy-4-[(E)-[2-(1-naphthalenylamino)-4-oxo-5-thiazolylidene]methyl]-6-nitrophenolate IUPAC Name: 2-methoxy-4-[(E)-[2-(naphthalen-1-ylamino)-4-oxo-1,3-thiazol-5-ylidene]methyl]-6-nitrophenolate Traditional Name: 4-[(E)-[4-keto-2-(1-naphthylamino)-2-thiazolin-5-ylidene]methyl]-2-methoxy-6-nitro-phenolate Formula: C21H14N3O5S- MolecularWeight: 420.41796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=O)N=C(S2)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C/2\C(=O)N=C(S2)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H15N3O5S/c1-29-17-10-12(9-16(19(17)25)24(27)28)11-18-20(26)23-21(30-18)22-15-8-4-6-13-5-2-3-7-14(13)15/h2-11,25H,1H3,(H,22,23,26)/p-1/b18-11+