ethyl 4-methyl-2-(3-nitro-4-piperidin-1-yl-phenyl)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-(3-nitro-4-piperidin-1-yl-phenyl)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[3-nitro-4-(1-piperidyl)phenyl]thiazole-5-carboxylate CAS Name: 4-methyl-2-[3-nitro-4-(1-piperidinyl)phenyl]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-(3-nitro-4-piperidin-1-ylphenyl)-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-(3-nitro-4-piperidino-phenyl)thiazole-5-carboxylic acid ethyl ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O4S/c1-3-25-18(22)16-12(2)19-17(26-16)13-7-8-14(15(11-13)21(23)24)20-9-5-4-6-10-20/h7-8,11H,3-6,9-10H2,1-2H3