2-cyclopropyl-5-[4-(2-methoxy-5-nitro-phenyl)carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-cyclopropyl-5-[4-(2-methoxy-5-nitro-phenyl)carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-cyclopropyl-5-[4-(2-methoxy-5-nitro-benzoyl)piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-cyclopropyl-5-[4-[(2-methoxy-5-nitrophenyl)-oxomethyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-cyclopropyl-5-[4-(2-methoxy-5-nitrobenzoyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-cyclopropyl-5-[4-(2-methoxy-5-nitro-benzoyl)piperazino]oxazole-4-carbonitrile Formula: C19H19N5O5 MolecularWeight: 397.38466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)C3=C(N=C(O3)C4CC4)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)C3=C(N=C(O3)C4CC4)C#N

InChI

InChI=1S/C19H19N5O5/c1-28-16-5-4-13(24(26)27)10-14(16)18(25)22-6-8-23(9-7-22)19-15(11-20)21-17(29-19)12-2-3-12/h4-5,10,12H,2-3,6-9H2,1H3