5-(1-methylbenzimidazol-2-yl)oxypentyl 4-methylbenzenesulfonate

Systemtic Name: 5-(1-methylbenzimidazol-2-yl)oxypentyl 4-methylbenzenesulfonate Openeye Name: 5-(1-methylbenzimidazol-2-yl)oxypentyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 5-[(1-methyl-2-benzimidazolyl)oxy]pentyl ester IUPAC Name: 5-(1-methylbenzimidazol-2-yl)oxypentyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 5-(1-methylbenzimidazol-2-yl)oxypentyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCOC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCOC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C20H24N2O4S/c1-16-10-12-17(13-11-16)27(23,24)26-15-7-3-6-14-25-20-21-18-8-4-5-9-19(18)22(20)2/h4-5,8-13H,3,6-7,14-15H2,1-2H3