propan-2-yl 2-[2-[5-(prop-2-enoylamino)pentyl]benzimidazol-1-yl]ethanoate

Systemtic Name: propan-2-yl 2-[2-[5-(prop-2-enoylamino)pentyl]benzimidazol-1-yl]ethanoate Openeye Name: isopropyl 2-[2-[5-(prop-2-enoylamino)pentyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[5-(1-oxoprop-2-enylamino)pentyl]-1-benzimidazolyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-[5-(prop-2-enoylamino)pentyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-(5-acrylamidopentyl)benzimidazol-1-yl]acetic acid isopropyl ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CN1C2=CC=CC=C2N=C1CCCCCNC(=O)C=C

Isomeric SMILES

CC(C)OC(=O)CN1C2=CC=CC=C2N=C1CCCCCNC(=O)C=C

InChI

InChI=1S/C20H27N3O3/c1-4-19(24)21-13-9-5-6-12-18-22-16-10-7-8-11-17(16)23(18)14-20(25)26-15(2)3/h4,7-8,10-11,15H,1,5-6,9,12-14H2,2-3H3,(H,21,24)