1-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: 1-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: 1-(1-benzyl-5-chloro-benzimidazol-2-yl)ethyl 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid 1-[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]ethyl ester IUPAC Name: 1-(1-benzyl-5-chlorobenzimidazol-2-yl)ethyl 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid 1-(1-benzyl-5-chloro-benzimidazol-2-yl)ethyl ester Formula: C26H22ClN3O5 MolecularWeight: 491.92298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)Cl)OC(=O)CNC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)Cl)OC(=O)CNC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H22ClN3O5/c1-16(35-24(31)13-28-26(32)18-7-10-22-23(11-18)34-15-33-22)25-29-20-12-19(27)8-9-21(20)30(25)14-17-5-3-2-4-6-17/h2-12,16H,13-15H2,1H3,(H,28,32)