2,3-dimethyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)aniline

Systemtic Name: 2,3-dimethyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)aniline Openeye Name: 2,3-dimethyl-N-(4-morpholinosulfonyl-2-nitro-phenyl)aniline CAS Name: 2,3-dimethyl-N-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]aniline IUPAC Name: 2,3-dimethyl-N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)aniline Traditional Name: (2,3-dimethylphenyl)-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O5S/c1-13-4-3-5-16(14(13)2)19-17-7-6-15(12-18(17)21(22)23)27(24,25)20-8-10-26-11-9-20/h3-7,12,19H,8-11H2,1-2H3