N-cyclopropyl-2-methoxy-4-nitro-N-[(4-propan-2-ylphenyl)methyl]benzenesulfonamide

Systemtic Name: N-cyclopropyl-2-methoxy-4-nitro-N-[(4-propan-2-ylphenyl)methyl]benzenesulfonamide Openeye Name: N-cyclopropyl-N-[(4-isopropylphenyl)methyl]-2-methoxy-4-nitro-benzenesulfonamide CAS Name: N-cyclopropyl-2-methoxy-4-nitro-N-[(4-propan-2-ylphenyl)methyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-2-methoxy-4-nitro-N-[(4-propan-2-ylphenyl)methyl]benzenesulfonamide Traditional Name: N-cyclopropyl-N-(4-isopropylbenzyl)-2-methoxy-4-nitro-benzenesulfonamide Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(C2CC2)S(=O)(=O)C3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(C2CC2)S(=O)(=O)C3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H24N2O5S/c1-14(2)16-6-4-15(5-7-16)13-21(17-8-9-17)28(25,26)20-11-10-18(22(23)24)12-19(20)27-3/h4-7,10-12,14,17H,8-9,13H2,1-3H3