4-[4-[3-(4-methyl-2-nitro-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde

Systemtic Name: 4-[4-[3-(4-methyl-2-nitro-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde Openeye Name: 4-[4-[3-(4-methyl-2-nitro-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde CAS Name: 4-[4-[3-(4-methyl-2-nitrophenoxy)-1-oxopropyl]-1-piperazinyl]benzaldehyde IUPAC Name: 4-[4-[3-(4-methyl-2-nitrophenoxy)propanoyl]piperazin-1-yl]benzaldehyde Traditional Name: 4-[4-[3-(4-methyl-2-nitro-phenoxy)propanoyl]piperazino]benzaldehyde Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c1-16-2-7-20(19(14-16)24(27)28)29-13-8-21(26)23-11-9-22(10-12-23)18-5-3-17(15-25)4-6-18/h2-7,14-15H,8-13H2,1H3