2-[4-(2-hydroxyethyl)piperazin-1-yl]-5-nitro-benzaldehyde

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-5-nitro-benzaldehyde Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-5-nitro-benzaldehyde CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazinyl]-5-nitrobenzaldehyde IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-5-nitrobenzaldehyde Traditional Name: 2-[4-(2-hydroxyethyl)piperazino]-5-nitro-benzaldehyde Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=C(C=C(C=C2)[N+](=O)[O-])C=O

Isomeric SMILES

C1CN(CCN1CCO)C2=C(C=C(C=C2)[N+](=O)[O-])C=O

InChI

InChI=1S/C13H17N3O4/c17-8-7-14-3-5-15(6-4-14)13-2-1-12(16(19)20)9-11(13)10-18/h1-2,9-10,17H,3-8H2