methyl 4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]benzoate Openeye Name: methyl 4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]benzoate CAS Name: 4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]benzoate Traditional Name: 4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]benzoic acid methyl ester Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(CC2=NC3=CC=CC=C3N2)C4CCCC5=C4N=CC=C5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(CC2=NC3=CC=CC=C3N2)C4CCCC5=C4N=CC=C5

InChI

InChI=1S/C26H26N4O2/c1-32-26(31)20-13-11-18(12-14-20)16-30(17-24-28-21-8-2-3-9-22(21)29-24)23-10-4-6-19-7-5-15-27-25(19)23/h2-3,5,7-9,11-15,23H,4,6,10,16-17H2,1H3,(H,28,29)