4-chloranyl-N-[3-methyl-1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[3-methyl-1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-methyl-1-[(3-sulfamoylphenyl)carbamoyl]propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[3-methyl-1-oxo-1-(3-sulfamoylanilino)butan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-methyl-1-oxo-1-(3-sulfamoylanilino)butan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-methyl-1-[(3-sulfamoylphenyl)carbamoyl]propyl]-3-nitro-benzamide Formula: C18H19ClN4O6S MolecularWeight: 454.88466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN4O6S/c1-10(2)16(18(25)21-12-4-3-5-13(9-12)30(20,28)29)22-17(24)11-6-7-14(19)15(8-11)23(26)27/h3-10,16H,1-2H3,(H,21,25)(H,22,24)(H2,20,28,29)