methyl 2-[2-[5-(2-ethylbutanoylamino)pentyl]benzimidazol-1-yl]ethanoate

Systemtic Name: methyl 2-[2-[5-(2-ethylbutanoylamino)pentyl]benzimidazol-1-yl]ethanoate Openeye Name: methyl 2-[2-[5-(2-ethylbutanoylamino)pentyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[5-[(2-ethyl-1-oxobutyl)amino]pentyl]-1-benzimidazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[5-(2-ethylbutanoylamino)pentyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[5-(2-ethylbutanoylamino)pentyl]benzimidazol-1-yl]acetic acid methyl ester Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NCCCCCC1=NC2=CC=CC=C2N1CC(=O)OC

Isomeric SMILES

CCC(CC)C(=O)NCCCCCC1=NC2=CC=CC=C2N1CC(=O)OC

InChI

InChI=1S/C21H31N3O3/c1-4-16(5-2)21(26)22-14-10-6-7-13-19-23-17-11-8-9-12-18(17)24(19)15-20(25)27-3/h8-9,11-12,16H,4-7,10,13-15H2,1-3H3,(H,22,26)