4-bromanyl-3-methyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)aniline

Systemtic Name: 4-bromanyl-3-methyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)aniline Openeye Name: 4-bromo-3-methyl-N-(4-morpholinosulfonyl-2-nitro-phenyl)aniline CAS Name: 4-bromo-3-methyl-N-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]aniline IUPAC Name: 4-bromo-3-methyl-N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)aniline Traditional Name: (4-bromo-3-methyl-phenyl)-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C17H18BrN3O5S MolecularWeight: 456.31092

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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-])Br

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrN3O5S/c1-12-10-13(2-4-15(12)18)19-16-5-3-14(11-17(16)21(22)23)27(24,25)20-6-8-26-9-7-20/h2-5,10-11,19H,6-9H2,1H3