2,5-dimethyl-4-[4-[3-(3-methyl-4-nitro-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde

Systemtic Name: 2,5-dimethyl-4-[4-[3-(3-methyl-4-nitro-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde Openeye Name: 2,5-dimethyl-4-[4-[3-(3-methyl-4-nitro-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde CAS Name: 2,5-dimethyl-4-[4-[3-(3-methyl-4-nitrophenoxy)-1-oxopropyl]-1-piperazinyl]benzaldehyde IUPAC Name: 2,5-dimethyl-4-[4-[3-(3-methyl-4-nitrophenoxy)propanoyl]piperazin-1-yl]benzaldehyde Traditional Name: 2,5-dimethyl-4-[4-[3-(3-methyl-4-nitro-phenoxy)propanoyl]piperazino]benzaldehyde Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=O)C)N2CCN(CC2)C(=O)CCOC3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1C=O)C)N2CCN(CC2)C(=O)CCOC3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H27N3O5/c1-16-14-22(17(2)12-19(16)15-27)24-7-9-25(10-8-24)23(28)6-11-31-20-4-5-21(26(29)30)18(3)13-20/h4-5,12-15H,6-11H2,1-3H3