ethyl 2-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]furan-3-carboxylate

Systemtic Name: ethyl 2-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]furan-3-carboxylate Openeye Name: ethyl 2-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-(2-nitrophenyl)-1-piperazinyl]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[4-(2-nitrophenyl)piperazino]methyl]furan-3-carboxylic acid ethyl ester Formula: C18H21N3O5 MolecularWeight: 359.37644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O5/c1-2-25-18(22)14-7-12-26-17(14)13-19-8-10-20(11-9-19)15-5-3-4-6-16(15)21(23)24/h3-7,12H,2,8-11,13H2,1H3