tert-butyl (3R)-3-[[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]carbamoyl]heptanoate

Systemtic Name: tert-butyl (3R)-3-[[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]carbamoyl]heptanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]carbamoyl]heptanoate CAS Name: (3R)-3-[[[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]amino]-oxomethyl]heptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]carbamoyl]heptanoate Traditional Name: (3R)-3-[[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]carbamoyl]enanthic acid tert-butyl ester Formula: C23H35N3O3 MolecularWeight: 401.5423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)OC(C)(C)C)C(=O)NC(C1=NC2=CC=CC=C2N1)C(C)C

Isomeric SMILES

CCCC[C@H](CC(=O)OC(C)(C)C)C(=O)N[C@H](C1=NC2=CC=CC=C2N1)C(C)C

InChI

InChI=1S/C23H35N3O3/c1-7-8-11-16(14-19(27)29-23(4,5)6)22(28)26-20(15(2)3)21-24-17-12-9-10-13-18(17)25-21/h9-10,12-13,15-16,20H,7-8,11,14H2,1-6H3,(H,24,25)(H,26,28)/t16-,20+/m1/s1