4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-nitro-benzaldehyde

Systemtic Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-nitro-benzaldehyde CAS Name: 4-[4-(2-hydroxyethyl)-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-nitrobenzaldehyde Traditional Name: 4-[4-(2-hydroxyethyl)piperazino]-3-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)C=O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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