N-(furan-2-ylmethyl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(2-furylmethyl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-(2-furanylmethyl)-4-(3-nitrophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-4-(3-nitrophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(2-furfuryl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide Formula: C16H18N4O6S MolecularWeight: 394.40232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O6S/c21-16(17-12-14-4-2-10-26-14)18-6-8-19(9-7-18)27(24,25)15-5-1-3-13(11-15)20(22)23/h1-5,10-11H,6-9,12H2,(H,17,21)