3-methyl-2-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 3-methyl-2-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 3-methyl-2-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 3-methyl-2-nitro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 3-methyl-2-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 3-methyl-2-nitro-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H19N3O5S/c1-13-5-4-6-16(17(13)21(23)24)18(22)19-14-7-9-15(10-8-14)27(25,26)20-11-2-3-12-20/h4-10H,2-3,11-12H2,1H3,(H,19,22)