N-methyl-4-nitro-N-(2-pyrrolidin-1-yl-1,2-dihydronaphthalen-1-yl)benzenesulfonamide

Systemtic Name: N-methyl-4-nitro-N-(2-pyrrolidin-1-yl-1,2-dihydronaphthalen-1-yl)benzenesulfonamide Openeye Name: N-methyl-4-nitro-N-(2-pyrrolidin-1-yl-1,2-dihydronaphthalen-1-yl)benzenesulfonamide CAS Name: N-methyl-4-nitro-N-[2-(1-pyrrolidinyl)-1,2-dihydronaphthalen-1-yl]benzenesulfonamide IUPAC Name: N-methyl-4-nitro-N-(2-pyrrolidin-1-yl-1,2-dihydronaphthalen-1-yl)benzenesulfonamide Traditional Name: N-methyl-4-nitro-N-(2-pyrrolidino-1,2-dihydronaphthalen-1-yl)benzenesulfonamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1C(C=CC2=CC=CC=C12)N3CCCC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C1C(C=CC2=CC=CC=C12)N3CCCC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O4S/c1-22(29(27,28)18-11-9-17(10-12-18)24(25)26)21-19-7-3-2-6-16(19)8-13-20(21)23-14-4-5-15-23/h2-3,6-13,20-21H,4-5,14-15H2,1H3