N-methyl-4-[2-(2-nitrophenyl)sulfonylphenoxy]pentan-1-amine

Systemtic Name: N-methyl-4-[2-(2-nitrophenyl)sulfonylphenoxy]pentan-1-amine Openeye Name: N-methyl-4-[2-(2-nitrophenyl)sulfonylphenoxy]pentan-1-amine CAS Name: N-methyl-4-[2-(2-nitrophenyl)sulfonylphenoxy]-1-pentanamine IUPAC Name: N-methyl-4-[2-(2-nitrophenyl)sulfonylphenoxy]pentan-1-amine Traditional Name: methyl-[4-[2-(2-nitrophenyl)sulfonylphenoxy]pentyl]amine Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCNC)OC1=CC=CC=C1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(CCCNC)OC1=CC=CC=C1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O5S/c1-14(8-7-13-19-2)25-16-10-4-6-12-18(16)26(23,24)17-11-5-3-9-15(17)20(21)22/h3-6,9-12,14,19H,7-8,13H2,1-2H3