4-azanyl-6-chloranyl-N3-(phenylmethyl)benzene-1,3-disulfonamide

Systemtic Name: 4-azanyl-6-chloranyl-N3-(phenylmethyl)benzene-1,3-disulfonamide Openeye Name: 4-amino-N3-benzyl-6-chloro-benzene-1,3-disulfonamide CAS Name: 4-amino-6-chloro-N3-(phenylmethyl)benzene-1,3-disulfonamide IUPAC Name: 4-amino-3-N-benzyl-6-chlorobenzene-1,3-disulfonamide Traditional Name: 4-amino-N'-benzyl-6-chloro-benzene-1,3-disulfonamide Formula: C13H14ClN3O4S2 MolecularWeight: 375.85096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2N)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2N)Cl)S(=O)(=O)N

InChI

InChI=1S/C13H14ClN3O4S2/c14-10-6-11(15)13(7-12(10)22(16,18)19)23(20,21)17-8-9-4-2-1-3-5-9/h1-7,17H,8,15H2,(H2,16,18,19)