4-[(Z)-[2-(4-ethoxyphenyl)imino-4-oxidanylidene-3-propyl-1,3-thiazolidin-5-ylidene]methyl]-2-nitro-phenolate

Systemtic Name: 4-[(Z)-[2-(4-ethoxyphenyl)imino-4-oxidanylidene-3-propyl-1,3-thiazolidin-5-ylidene]methyl]-2-nitro-phenolate Openeye Name: 4-[(Z)-[2-(4-ethoxyphenyl)imino-4-oxo-3-propyl-thiazolidin-5-ylidene]methyl]-2-nitro-phenolate CAS Name: 4-[(Z)-[2-(4-ethoxyphenyl)imino-4-oxo-3-propyl-5-thiazolidinylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-[2-(4-ethoxyphenyl)imino-4-oxo-3-propyl-1,3-thiazolidin-5-ylidene]methyl]-2-nitrophenolate Traditional Name: 4-[(Z)-(4-keto-2-p-phenetylimino-3-propyl-thiazolidin-5-ylidene)methyl]-2-nitro-phenolate Formula: C21H20N3O5S- MolecularWeight: 426.4656

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CC2=CC(=C(C=C2)[O-])[N+](=O)[O-])SC1=NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCN1C(=O)/C(=C/C2=CC(=C(C=C2)[O-])[N+](=O)[O-])/SC1=NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H21N3O5S/c1-3-11-23-20(26)19(13-14-5-10-18(25)17(12-14)24(27)28)30-21(23)22-15-6-8-16(9-7-15)29-4-2/h5-10,12-13,25H,3-4,11H2,1-2H3/p-1/b19-13-,22-21?