3-methyl-4-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]benzaldehyde

Systemtic Name: 3-methyl-4-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]benzaldehyde Openeye Name: 3-methyl-4-[4-(4-nitrobenzoyl)piperazin-1-yl]benzaldehyde CAS Name: 3-methyl-4-[4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]benzaldehyde IUPAC Name: 3-methyl-4-[4-(4-nitrobenzoyl)piperazin-1-yl]benzaldehyde Traditional Name: 3-methyl-4-[4-(4-nitrobenzoyl)piperazino]benzaldehyde Formula: C19H19N3O4 MolecularWeight: 353.37186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O4/c1-14-12-15(13-23)2-7-18(14)20-8-10-21(11-9-20)19(24)16-3-5-17(6-4-16)22(25)26/h2-7,12-13H,8-11H2,1H3