2,4-bis(chloranyl)-11H-pyrido[1,2-b][2,4]benzodiazepin-12-ium-6-amine

Systemtic Name: 2,4-bis(chloranyl)-11H-pyrido[1,2-b][2,4]benzodiazepin-12-ium-6-amine Openeye Name: 2,4-dichloro-11H-pyrido[1,2-b][2,4]benzodiazepin-12-ium-6-amine CAS Name: 2,4-dichloro-11H-pyrido[1,2-b][2,4]benzodiazepin-12-ium-6-amine IUPAC Name: 2,4-dichloro-11H-pyrido[1,2-b][2,4]benzodiazepin-12-ium-6-amine Traditional Name: (2,4-dichloro-11H-pyrido[1,2-b][2,4]benzodiazepin-12-ium-6-yl)amine Formula: C13H10Cl2N3+ MolecularWeight: 279.1446

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC3=C(C=C(C=[N+]31)Cl)Cl)N

Isomeric SMILES

C1C2=CC=CC=C2C(=NC3=C(C=C(C=[N+]31)Cl)Cl)N

InChI

InChI=1S/C13H9Cl2N3/c14-9-5-11(15)13-17-12(16)10-4-2-1-3-8(10)6-18(13)7-9/h1-5,7,16H,6H2/p+1