[2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl] cyclobutanecarboxylate

Systemtic Name: [2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl] cyclobutanecarboxylate Openeye Name: [2-[allyl-[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-oxo-ethyl] cyclobutanecarboxylate CAS Name: cyclobutanecarboxylic acid [2-[[4-(4-nitrophenyl)-2-thiazolyl]-prop-2-enylamino]-2-oxoethyl] ester IUPAC Name: [2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enylamino]-2-oxoethyl] cyclobutanecarboxylate Traditional Name: cyclobutanecarboxylic acid [2-[allyl-[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-keto-ethyl] ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)COC(=O)C3CCC3

Isomeric SMILES

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)COC(=O)C3CCC3

InChI

InChI=1S/C19H19N3O5S/c1-2-10-21(17(23)11-27-18(24)14-4-3-5-14)19-20-16(12-28-19)13-6-8-15(9-7-13)22(25)26/h2,6-9,12,14H,1,3-5,10-11H2