3-nitro-4-(4-prop-2-enylpiperazin-1-yl)benzaldehyde

Systemtic Name: 3-nitro-4-(4-prop-2-enylpiperazin-1-yl)benzaldehyde Openeye Name: 4-(4-allylpiperazin-1-yl)-3-nitro-benzaldehyde CAS Name: 3-nitro-4-(4-prop-2-enyl-1-piperazinyl)benzaldehyde IUPAC Name: 3-nitro-4-(4-prop-2-enylpiperazin-1-yl)benzaldehyde Traditional Name: 4-(4-allylpiperazino)-3-nitro-benzaldehyde Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)C2=C(C=C(C=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

C=CCN1CCN(CC1)C2=C(C=C(C=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O3/c1-2-5-15-6-8-16(9-7-15)13-4-3-12(11-18)10-14(13)17(19)20/h2-4,10-11H,1,5-9H2