[1,3-dimethyl-2,6-bis(oxidanylidene)-7-phenacyl-purin-8-yl]methyl-bis(phenylmethyl)azanium

Systemtic Name: [1,3-dimethyl-2,6-bis(oxidanylidene)-7-phenacyl-purin-8-yl]methyl-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[(1,3-dimethyl-2,6-dioxo-7-phenacyl-purin-8-yl)methyl]ammonium CAS Name: (1,3-dimethyl-2,6-dioxo-7-phenacyl-8-purinyl)methyl-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(1,3-dimethyl-2,6-dioxo-7-phenacylpurin-8-yl)methyl]azanium Traditional Name: dibenzyl-[(2,6-diketo-1,3-dimethyl-7-phenacyl-purin-8-yl)methyl]ammonium Formula: C30H30N5O3+ MolecularWeight: 508.5909

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C[NH+](CC3=CC=CC=C3)CC4=CC=CC=C4)CC(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C[NH+](CC3=CC=CC=C3)CC4=CC=CC=C4)CC(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H29N5O3/c1-32-28-27(29(37)33(2)30(32)38)35(20-25(36)24-16-10-5-11-17-24)26(31-28)21-34(18-22-12-6-3-7-13-22)19-23-14-8-4-9-15-23/h3-17H,18-21H2,1-2H3/p+1