ethyl 3-[3-[2-azanylidene-3-[(3-bromophenyl)methyl]benzimidazol-1-yl]propoxy]benzoate

Systemtic Name: ethyl 3-[3-[2-azanylidene-3-[(3-bromophenyl)methyl]benzimidazol-1-yl]propoxy]benzoate Openeye Name: ethyl 3-[3-[3-[(3-bromophenyl)methyl]-2-imino-benzimidazol-1-yl]propoxy]benzoate CAS Name: 3-[3-[3-[(3-bromophenyl)methyl]-2-imino-1-benzimidazolyl]propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-[3-[(3-bromophenyl)methyl]-2-iminobenzimidazol-1-yl]propoxy]benzoate Traditional Name: 3-[3-[3-(3-bromobenzyl)-2-imino-benzimidazol-1-yl]propoxy]benzoic acid ethyl ester Formula: C26H26BrN3O3 MolecularWeight: 508.40694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)OCCCN2C3=CC=CC=C3N(C2=N)CC4=CC(=CC=C4)Br

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)OCCCN2C3=CC=CC=C3N(C2=N)CC4=CC(=CC=C4)Br

InChI

InChI=1S/C26H26BrN3O3/c1-2-32-25(31)20-9-6-11-22(17-20)33-15-7-14-29-23-12-3-4-13-24(23)30(26(29)28)18-19-8-5-10-21(27)16-19/h3-6,8-13,16-17,28H,2,7,14-15,18H2,1H3