N-methyl-N-[(2-methylphenyl)methyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-methyl-N-[(2-methylphenyl)methyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-methyl-2-morpholinosulfonyl-4-nitro-N-(o-tolylmethyl)aniline CAS Name: N-methyl-N-[(2-methylphenyl)methyl]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-methyl-N-[(2-methylphenyl)methyl]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: methyl-(2-methylbenzyl)-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H23N3O5S/c1-15-5-3-4-6-16(15)14-20(2)18-8-7-17(22(23)24)13-19(18)28(25,26)21-9-11-27-12-10-21/h3-8,13H,9-12,14H2,1-2H3