4-(4-cyclopentylpiperazin-1-yl)-3-nitro-benzaldehyde

Systemtic Name: 4-(4-cyclopentylpiperazin-1-yl)-3-nitro-benzaldehyde Openeye Name: 4-(4-cyclopentylpiperazin-1-yl)-3-nitro-benzaldehyde CAS Name: 4-(4-cyclopentyl-1-piperazinyl)-3-nitrobenzaldehyde IUPAC Name: 4-(4-cyclopentylpiperazin-1-yl)-3-nitrobenzaldehyde Traditional Name: 4-(4-cyclopentylpiperazino)-3-nitro-benzaldehyde Formula: C16H21N3O3 MolecularWeight: 303.35624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCN(CC2)C3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N2CCN(CC2)C3=C(C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O3/c20-12-13-5-6-15(16(11-13)19(21)22)18-9-7-17(8-10-18)14-3-1-2-4-14/h5-6,11-12,14H,1-4,7-10H2