N3-[2-[bis(fluoranyl)methoxy]phenyl]quinoxaline-2,3-diamine; 4-methylbenzenesulfinate

Systemtic Name: N3-[2-[bis(fluoranyl)methoxy]phenyl]quinoxaline-2,3-diamine; 4-methylbenzenesulfinate Openeye Name: N3-[2-(difluoromethoxy)phenyl]quinoxaline-2,3-diamine; 4-methylbenzenesulfinate CAS Name: N3-[2-(difluoromethoxy)phenyl]quinoxaline-2,3-diamine; 4-methylbenzenesulfinate IUPAC Name: 3-N-[2-(difluoromethoxy)phenyl]quinoxaline-2,3-diamine; 4-methylbenzenesulfinate Traditional Name: (3-aminoquinoxalin-2-yl)-[2-(difluoromethoxy)phenyl]amine; 4-methylbenzenesulfinate Formula: C22H19F2N4O3S- MolecularWeight: 457.473066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)[O-].C1=CC=C2C(=C1)N=C(C(=N2)NC3=CC=CC=C3OC(F)F)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)[O-].C1=CC=C2C(=C1)N=C(C(=N2)NC3=CC=CC=C3OC(F)F)N

InChI

InChI=1S/C15H12F2N4O.C7H8O2S/c16-15(17)22-12-8-4-3-7-11(12)21-14-13(18)19-9-5-1-2-6-10(9)20-14;1-6-2-4-7(5-3-6)10(8)9/h1-8,15H,(H2,18,19)(H,20,21);2-5H,1H3,(H,8,9)/p-1