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

Systemtic Name: methyl 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]furan-3-carboxylate Openeye Name: methyl 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[4-(4-nitrophenyl)piperazino]methyl]furan-3-carboxylic acid methyl ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O5/c1-24-17(21)15-6-11-25-16(15)12-18-7-9-19(10-8-18)13-2-4-14(5-3-13)20(22)23/h2-6,11H,7-10,12H2,1H3