4-[[2-(methoxymethyl)phenyl]methylamino]-N-[(2S)-1-methoxypropan-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[2-(methoxymethyl)phenyl]methylamino]-N-[(2S)-1-methoxypropan-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[(1S)-2-methoxy-1-methyl-ethyl]-4-[[2-(methoxymethyl)phenyl]methylamino]-3-nitro-benzenesulfonamide CAS Name: 4-[[2-(methoxymethyl)phenyl]methylamino]-N-[(2S)-1-methoxypropan-2-yl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[[2-(methoxymethyl)phenyl]methylamino]-N-[(2S)-1-methoxypropan-2-yl]-3-nitrobenzenesulfonamide Traditional Name: 4-[[2-(methoxymethyl)benzyl]amino]-N-[(1S)-2-methoxy-1-methyl-ethyl]-3-nitro-benzenesulfonamide Formula: C19H25N3O6S MolecularWeight: 423.4833

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2COC)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](COC)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2COC)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O6S/c1-14(12-27-2)21-29(25,26)17-8-9-18(19(10-17)22(23)24)20-11-15-6-4-5-7-16(15)13-28-3/h4-10,14,20-21H,11-13H2,1-3H3/t14-/m0/s1