tris(4-azanyl-2-methyl-quinolin-6-yl)-(1,3,5-triazin-2-yl)azanium

Systemtic Name: tris(4-azanyl-2-methyl-quinolin-6-yl)-(1,3,5-triazin-2-yl)azanium Openeye Name: tris(4-amino-2-methyl-6-quinolyl)-(1,3,5-triazin-2-yl)ammonium CAS Name: tris(4-amino-2-methyl-6-quinolinyl)-(1,3,5-triazin-2-yl)ammonium IUPAC Name: tris(4-amino-2-methylquinolin-6-yl)-(1,3,5-triazin-2-yl)azanium Traditional Name: tris(4-amino-2-methyl-6-quinolyl)-(s-triazin-2-yl)ammonium Formula: C33H29N10+ MolecularWeight: 565.65036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)[N+](C3=CC4=C(C=C3)N=C(C=C4N)C)(C5=CC6=C(C=C5)N=C(C=C6N)C)C7=NC=NC=N7)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)[N+](C3=CC4=C(C=C3)N=C(C=C4N)C)(C5=CC6=C(C=C5)N=C(C=C6N)C)C7=NC=NC=N7)C(=C1)N

InChI

InChI=1S/C33H29N10/c1-18-10-27(34)24-13-21(4-7-30(24)40-18)43(33-38-16-37-17-39-33,22-5-8-31-25(14-22)28(35)11-19(2)41-31)23-6-9-32-26(15-23)29(36)12-20(3)42-32/h4-17H,1-3H3,(H2,34,40)(H2,35,41)(H2,36,42)/q+1