[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-pyrrolidin-1-yl-methanone CAS Name: [4-(2,3-dimethyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-(2,3-dimethyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazino]-pyrrolidino-methanone Formula: C17H24N4O5S MolecularWeight: 396.46126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H24N4O5S/c1-13-11-15(21(23)24)12-16(14(13)2)27(25,26)20-9-7-19(8-10-20)17(22)18-5-3-4-6-18/h11-12H,3-10H2,1-2H3