1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-N-(furan-2-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-N-(furan-2-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-N-(2-furylmethyl)pyrrolidine-2-carboxamide CAS Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-N-(2-furanylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-N-(furan-2-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-N-(2-furfuryl)pyrrolidine-2-carboxamide Formula: C17H18ClN3O6S MolecularWeight: 427.85932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCCC2C(=O)NCC3=CC=CO3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCCC2C(=O)NCC3=CC=CO3)Cl

InChI

InChI=1S/C17H18ClN3O6S/c1-11-14(18)8-13(9-16(11)21(23)24)28(25,26)20-6-2-5-15(20)17(22)19-10-12-4-3-7-27-12/h3-4,7-9,15H,2,5-6,10H2,1H3,(H,19,22)