4-methylsulfonyl-2-nitro-N-[3-(2,3,5-trimethylphenoxy)propyl]aniline

Systemtic Name: 4-methylsulfonyl-2-nitro-N-[3-(2,3,5-trimethylphenoxy)propyl]aniline Openeye Name: 4-methylsulfonyl-2-nitro-N-[3-(2,3,5-trimethylphenoxy)propyl]aniline CAS Name: 4-methylsulfonyl-2-nitro-N-[3-(2,3,5-trimethylphenoxy)propyl]aniline IUPAC Name: 4-methylsulfonyl-2-nitro-N-[3-(2,3,5-trimethylphenoxy)propyl]aniline Traditional Name: (4-mesyl-2-nitro-phenyl)-[3-(2,3,5-trimethylphenoxy)propyl]amine Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C19H24N2O5S/c1-13-10-14(2)15(3)19(11-13)26-9-5-8-20-17-7-6-16(27(4,24)25)12-18(17)21(22)23/h6-7,10-12,20H,5,8-9H2,1-4H3