2-[3-[(3-bromophenyl)amino]-2-oxidanyl-propyl]guanidine; sulfuric acid

Systemtic Name: 2-[3-[(3-bromophenyl)amino]-2-oxidanyl-propyl]guanidine; sulfuric acid Openeye Name: 2-[3-(3-bromoanilino)-2-hydroxy-propyl]guanidine; sulfuric acid CAS Name: 2-[3-(3-bromoanilino)-2-hydroxypropyl]guanidine; sulfuric acid IUPAC Name: 2-[3-(3-bromoanilino)-2-hydroxypropyl]guanidine; sulfuric acid Traditional Name: 2-[3-(3-bromoanilino)-2-hydroxy-propyl]guanidine; sulfuric acid Formula: C20H32Br2N8O6S MolecularWeight: 672.39108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NCC(CN=C(N)N)O.C1=CC(=CC(=C1)Br)NCC(CN=C(N)N)O.OS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)NCC(CN=C(N)N)O.C1=CC(=CC(=C1)Br)NCC(CN=C(N)N)O.OS(=O)(=O)O

InChI

InChI=1S/2C10H15BrN4O.H2O4S/c2*11-7-2-1-3-8(4-7)14-5-9(16)6-15-10(12)13;1-5(2,3)4/h2*1-4,9,14,16H,5-6H2,(H4,12,13,15);(H2,1,2,3,4)