N-[4-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]-4-oxidanylidene-butyl]benzamide

Systemtic Name: N-[4-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]-4-oxidanylidene-butyl]benzamide Openeye Name: N-[4-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]-4-oxo-butyl]benzamide CAS Name: N-[4-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-4-oxobutyl]benzamide IUPAC Name: N-[4-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-4-oxobutyl]benzamide Traditional Name: N-[4-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]-4-keto-butyl]benzamide Formula: C18H18ClN3O6S MolecularWeight: 439.87002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC(=O)CCCNC(=O)C2=CC=CC=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC(=O)CCCNC(=O)C2=CC=CC=C2)Cl

InChI

InChI=1S/C18H18ClN3O6S/c1-12-15(19)10-14(11-16(12)22(25)26)29(27,28)21-17(23)8-5-9-20-18(24)13-6-3-2-4-7-13/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,20,24)(H,21,23)