N-(4-bromanyl-2-methyl-phenyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide CAS Name: N-(4-bromo-2-methylphenyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-3-(nosylamino)propionamide Formula: C16H16BrN3O5S MolecularWeight: 442.28434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16BrN3O5S/c1-11-10-12(17)2-7-15(11)19-16(21)8-9-18-26(24,25)14-5-3-13(4-6-14)20(22)23/h2-7,10,18H,8-9H2,1H3,(H,19,21)