[3-(6-carbamimidoyl-4-methyl-2-propyl-benzimidazol-1-yl)-2-methyl-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [3-(6-carbamimidoyl-4-methyl-2-propyl-benzimidazol-1-yl)-2-methyl-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [3-(6-carbamimidoyl-4-methyl-2-propyl-benzimidazol-1-yl)-2-methyl-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [3-(6-carbamimidoyl-4-methyl-2-propyl-1-benzimidazolyl)-2-methyl-6-phenylphenyl] ester IUPAC Name: [3-(6-carbamimidoyl-4-methyl-2-propylbenzimidazol-1-yl)-2-methyl-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [3-(6-amidino-4-methyl-2-propyl-benzimidazol-1-yl)-2-methyl-6-phenyl-phenyl] ester Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C(=N)N)C

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)C(=N)N)C

InChI

InChI=1S/C26H26N4O3/c1-4-8-22-29-23-15(2)13-18(25(27)28)14-21(23)30(22)20-12-11-19(17-9-6-5-7-10-17)24(16(20)3)33-26(31)32/h5-7,9-14H,4,8H2,1-3H3,(H3,27,28)(H,31,32)