[2-[[3-cyclopentyl-2-(4-nitrophenyl)propanoyl]amino]-1,3-thiazol-4-yl] methyl carbonate

Systemtic Name: [2-[[3-cyclopentyl-2-(4-nitrophenyl)propanoyl]amino]-1,3-thiazol-4-yl] methyl carbonate Openeye Name: [2-[[3-cyclopentyl-2-(4-nitrophenyl)propanoyl]amino]thiazol-4-yl] methyl carbonate CAS Name: carbonic acid [2-[[3-cyclopentyl-2-(4-nitrophenyl)-1-oxopropyl]amino]-4-thiazolyl] methyl ester IUPAC Name: [2-[[3-cyclopentyl-2-(4-nitrophenyl)propanoyl]amino]-1,3-thiazol-4-yl] methyl carbonate Traditional Name: carbonic acid [2-[[3-cyclopentyl-2-(4-nitrophenyl)propanoyl]amino]thiazol-4-yl] methyl ester Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC1=CSC(=N1)NC(=O)C(CC2CCCC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)OC1=CSC(=N1)NC(=O)C(CC2CCCC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-27-19(24)28-16-11-29-18(20-16)21-17(23)15(10-12-4-2-3-5-12)13-6-8-14(9-7-13)22(25)26/h6-9,11-12,15H,2-5,10H2,1H3,(H,20,21,23)