4-(2-methyl-3-nitro-phenyl)carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-(2-methyl-3-nitro-phenyl)carbonylpiperazine-1-carbaldehyde Openeye Name: 4-(2-methyl-3-nitro-benzoyl)piperazine-1-carbaldehyde CAS Name: 4-[(2-methyl-3-nitrophenyl)-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-(2-methyl-3-nitrobenzoyl)piperazine-1-carbaldehyde Traditional Name: 4-(2-methyl-3-nitro-benzoyl)piperazine-1-carbaldehyde Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O4/c1-10-11(3-2-4-12(10)16(19)20)13(18)15-7-5-14(9-17)6-8-15/h2-4,9H,5-8H2,1H3