4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]-3-methoxy-5-nitro-benzaldehyde

Systemtic Name: 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]-3-methoxy-5-nitro-benzaldehyde Openeye Name: 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-oxo-ethoxy]-3-methoxy-5-nitro-benzaldehyde CAS Name: 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-1-piperazinyl]-2-oxoethoxy]-3-methoxy-5-nitrobenzaldehyde IUPAC Name: 4-[2-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-oxoethoxy]-3-methoxy-5-nitrobenzaldehyde Traditional Name: 4-[2-[4-(4-fluorobenzyl)-2,5-dimethyl-piperazino]-2-keto-ethoxy]-3-methoxy-5-nitro-benzaldehyde Formula: C23H26FN3O6 MolecularWeight: 459.467443

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)COC2=C(C=C(C=C2OC)C=O)[N+](=O)[O-])C)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1CN(C(CN1C(=O)COC2=C(C=C(C=C2OC)C=O)[N+](=O)[O-])C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C23H26FN3O6/c1-15-11-26(16(2)10-25(15)12-17-4-6-19(24)7-5-17)22(29)14-33-23-20(27(30)31)8-18(13-28)9-21(23)32-3/h4-9,13,15-16H,10-12,14H2,1-3H3