ethyl 4-[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl 4-[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl 4-[4-[4-(2-nitrophenyl)thiazol-2-yl]-1-piperidyl]-4-oxo-but-2-enoate CAS Name: 4-[4-[4-(2-nitrophenyl)-2-thiazolyl]-1-piperidinyl]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-4-oxobut-2-enoate Traditional Name: 4-keto-4-[4-[4-(2-nitrophenyl)thiazol-2-yl]piperidino]but-2-enoic acid ethyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)N1CCC(CC1)C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C=CC(=O)N1CCC(CC1)C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5S/c1-2-28-19(25)8-7-18(24)22-11-9-14(10-12-22)20-21-16(13-29-20)15-5-3-4-6-17(15)23(26)27/h3-8,13-14H,2,9-12H2,1H3