4-chloranyl-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(2-furylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(2-furanylmethyl)-N-[(1-methyl-2-pyrrolyl)methyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(2-furfuryl)-N-[(1-methylpyrrol-2-yl)methyl]-3-nitro-benzenesulfonamide Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CO2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CO2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5S/c1-19-8-2-4-13(19)11-20(12-14-5-3-9-26-14)27(24,25)15-6-7-16(18)17(10-15)21(22)23/h2-10H,11-12H2,1H3