3,5-dimethyl-4-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]benzaldehyde

Systemtic Name: 3,5-dimethyl-4-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]benzaldehyde Openeye Name: 3,5-dimethyl-4-[4-(4-nitrobenzoyl)piperazin-1-yl]benzaldehyde CAS Name: 3,5-dimethyl-4-[4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]benzaldehyde IUPAC Name: 3,5-dimethyl-4-[4-(4-nitrobenzoyl)piperazin-1-yl]benzaldehyde Traditional Name: 3,5-dimethyl-4-[4-(4-nitrobenzoyl)piperazino]benzaldehyde Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O4/c1-14-11-16(13-24)12-15(2)19(14)21-7-9-22(10-8-21)20(25)17-3-5-18(6-4-17)23(26)27/h3-6,11-13H,7-10H2,1-2H3