2-[methylsulfonyl-(3-nitrophenyl)amino]-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: 2-[methylsulfonyl-(3-nitrophenyl)amino]-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-(N-methylsulfonyl-3-nitro-anilino)-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-(N-mesyl-3-nitro-anilino)-N-(tetrahydrofurfuryl)acetamide Formula: C14H19N3O6S MolecularWeight: 357.38216

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1CCCO1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1CCCO1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O6S/c1-24(21,22)16(11-4-2-5-12(8-11)17(19)20)10-14(18)15-9-13-6-3-7-23-13/h2,4-5,8,13H,3,6-7,9-10H2,1H3,(H,15,18)