3-nitro-4-[4-(2-phenoxyethanoyl)piperazin-1-yl]benzaldehyde

Systemtic Name: 3-nitro-4-[4-(2-phenoxyethanoyl)piperazin-1-yl]benzaldehyde Openeye Name: 3-nitro-4-[4-(2-phenoxyacetyl)piperazin-1-yl]benzaldehyde CAS Name: 3-nitro-4-[4-(1-oxo-2-phenoxyethyl)-1-piperazinyl]benzaldehyde IUPAC Name: 3-nitro-4-[4-(2-phenoxyacetyl)piperazin-1-yl]benzaldehyde Traditional Name: 3-nitro-4-[4-(2-phenoxyacetyl)piperazino]benzaldehyde Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C=O)[N+](=O)[O-])C(=O)COC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C=O)[N+](=O)[O-])C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O5/c23-13-15-6-7-17(18(12-15)22(25)26)20-8-10-21(11-9-20)19(24)14-27-16-4-2-1-3-5-16/h1-7,12-13H,8-11,14H2