2-[4-[[4-methyl-6-[2-(methylamino)ethylcarbamoyl]-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoate

Systemtic Name: 2-[4-[[4-methyl-6-[2-(methylamino)ethylcarbamoyl]-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoate Openeye Name: 2-[4-[[4-methyl-6-[2-(methylamino)ethylcarbamoyl]-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[4-methyl-6-[[2-(methylamino)ethylamino]-oxomethyl]-2-propyl-1-benzimidazolyl]methyl]phenyl]benzoate IUPAC Name: 2-[4-[[4-methyl-6-[2-(methylamino)ethylcarbamoyl]-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[4-methyl-6-[2-(methylamino)ethylcarbamoyl]-2-propyl-benzimidazol-1-yl]methyl]phenyl]benzoate Formula: C29H31N4O3- MolecularWeight: 483.58144

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)[O-])C(=O)NCCNC)C

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)[O-])C(=O)NCCNC)C

InChI

InChI=1S/C29H32N4O3/c1-4-7-26-32-27-19(2)16-22(28(34)31-15-14-30-3)17-25(27)33(26)18-20-10-12-21(13-11-20)23-8-5-6-9-24(23)29(35)36/h5-6,8-13,16-17,30H,4,7,14-15,18H2,1-3H3,(H,31,34)(H,35,36)/p-1