4-methyl-3-nitro-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[2-(pyrrolidinomethyl)benzyl]benzenesulfonamide Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2CN3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2CN3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O4S/c1-15-8-9-18(12-19(15)22(23)24)27(25,26)20-13-16-6-2-3-7-17(16)14-21-10-4-5-11-21/h2-3,6-9,12,20H,4-5,10-11,13-14H2,1H3