(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl-bis(2-chloroethyl)azanium

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl-bis(2-chloroethyl)azanium Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl-bis(2-chloroethyl)ammonium CAS Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl-bis(2-chloroethyl)ammonium IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl-bis(2-chloroethyl)azanium Traditional Name: (4-amino-6-anilino-s-triazin-2-yl)methyl-bis(2-chloroethyl)ammonium Formula: C14H19Cl2N6+ MolecularWeight: 342.24686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C[NH+](CCCl)CCCl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C[NH+](CCCl)CCCl

InChI

InChI=1S/C14H18Cl2N6/c15-6-8-22(9-7-16)10-12-19-13(17)21-14(20-12)18-11-4-2-1-3-5-11/h1-5H,6-10H2,(H3,17,18,19,20,21)/p+1