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

Systemtic Name: [2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl] cyclopentanecarboxylate Openeye Name: [2-[allyl-[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-oxo-ethyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic 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] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [2-[allyl-[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-keto-ethyl] ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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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)C3CCCC3

Isomeric SMILES

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)COC(=O)C3CCCC3

InChI

InChI=1S/C20H21N3O5S/c1-2-11-22(18(24)12-28-19(25)15-5-3-4-6-15)20-21-17(13-29-20)14-7-9-16(10-8-14)23(26)27/h2,7-10,13,15H,1,3-6,11-12H2