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

Systemtic Name: 3,5-dimethyl-4-[4-[3-(3-methyl-4-nitro-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde Openeye Name: 3,5-dimethyl-4-[4-[3-(3-methyl-4-nitro-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde CAS Name: 3,5-dimethyl-4-[4-[3-(3-methyl-4-nitrophenoxy)-1-oxopropyl]-1-piperazinyl]benzaldehyde IUPAC Name: 3,5-dimethyl-4-[4-[3-(3-methyl-4-nitrophenoxy)propanoyl]piperazin-1-yl]benzaldehyde Traditional Name: 3,5-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(=CC(=C1N2CCN(CC2)C(=O)CCOC3=CC(=C(C=C3)[N+](=O)[O-])C)C)C=O

Isomeric SMILES

CC1=CC(=CC(=C1N2CCN(CC2)C(=O)CCOC3=CC(=C(C=C3)[N+](=O)[O-])C)C)C=O

InChI

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