ethyl 3-[[2-(2-methylphenyl)imino-1,3-thiazolidin-3-yl]carbonyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[2-(2-methylphenyl)imino-1,3-thiazolidin-3-yl]carbonyl]-5-nitro-benzoate Openeye Name: ethyl 3-nitro-5-[2-(o-tolylimino)thiazolidine-3-carbonyl]benzoate CAS Name: 3-[[2-(2-methylphenyl)imino-3-thiazolidinyl]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(2-methylphenyl)imino-1,3-thiazolidine-3-carbonyl]-5-nitrobenzoate Traditional Name: 3-nitro-5-[2-(o-tolylimino)thiazolidine-3-carbonyl]benzoic acid ethyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCSC2=NC3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCSC2=NC3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O5S/c1-3-28-19(25)15-10-14(11-16(12-15)23(26)27)18(24)22-8-9-29-20(22)21-17-7-5-4-6-13(17)2/h4-7,10-12H,3,8-9H2,1-2H3