4-(4-methylphenyl)sulfonyl-2-(2-nitrophenyl)-5-piperidin-1-yl-1,3-oxazole

Systemtic Name: 4-(4-methylphenyl)sulfonyl-2-(2-nitrophenyl)-5-piperidin-1-yl-1,3-oxazole Openeye Name: 2-(2-nitrophenyl)-5-(1-piperidyl)-4-(p-tolylsulfonyl)oxazole CAS Name: 4-(4-methylphenyl)sulfonyl-2-(2-nitrophenyl)-5-(1-piperidinyl)oxazole IUPAC Name: 4-(4-methylphenyl)sulfonyl-2-(2-nitrophenyl)-5-piperidin-1-yl-1,3-oxazole Traditional Name: 2-(2-nitrophenyl)-5-piperidino-4-tosyl-oxazole Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CC=C3[N+](=O)[O-])N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CC=C3[N+](=O)[O-])N4CCCCC4

InChI

InChI=1S/C21H21N3O5S/c1-15-9-11-16(12-10-15)30(27,28)20-21(23-13-5-2-6-14-23)29-19(22-20)17-7-3-4-8-18(17)24(25)26/h3-4,7-12H,2,5-6,13-14H2,1H3