tert-butyl 2-[4-[[2-methyl-6-(pyrrolidin-1-ylcarbonylamino)benzimidazol-1-yl]methyl]phenyl]benzoate

Systemtic Name: tert-butyl 2-[4-[[2-methyl-6-(pyrrolidin-1-ylcarbonylamino)benzimidazol-1-yl]methyl]phenyl]benzoate Openeye Name: tert-butyl 2-[4-[[2-methyl-6-(pyrrolidine-1-carbonylamino)benzimidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[2-methyl-6-[[oxo(1-pyrrolidinyl)methyl]amino]-1-benzimidazolyl]methyl]phenyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[[2-methyl-6-(pyrrolidine-1-carbonylamino)benzimidazol-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[2-methyl-6-(pyrrolidine-1-carbonylamino)benzimidazol-1-yl]methyl]phenyl]benzoic acid tert-butyl ester Formula: C31H34N4O3 MolecularWeight: 510.62666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC(C)(C)C)C=C(C=C2)NC(=O)N5CCCC5

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC(C)(C)C)C=C(C=C2)NC(=O)N5CCCC5

InChI

InChI=1S/C31H34N4O3/c1-21-32-27-16-15-24(33-30(37)34-17-7-8-18-34)19-28(27)35(21)20-22-11-13-23(14-12-22)25-9-5-6-10-26(25)29(36)38-31(2,3)4/h5-6,9-16,19H,7-8,17-18,20H2,1-4H3,(H,33,37)