1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[2-(3-hex-5-ynoxypropylamino)-5,6-dimethyl-benzimidazol-1-yl]ethanone

Systemtic Name: 1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[2-(3-hex-5-ynoxypropylamino)-5,6-dimethyl-benzimidazol-1-yl]ethanone Openeye Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[2-(3-hex-5-ynoxypropylamino)-5,6-dimethyl-benzimidazol-1-yl]ethanone CAS Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-(3-hex-5-ynoxypropylamino)-5,6-dimethyl-1-benzimidazolyl]ethanone IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[2-(3-hex-5-ynoxypropylamino)-5,6-dimethylbenzimidazol-1-yl]ethanone Traditional Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[2-(3-hex-5-ynoxypropylamino)-5,6-dimethyl-benzimidazol-1-yl]ethanone Formula: C34H47N3O3 MolecularWeight: 545.75528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)NCCCOCCCCC#C)CC(=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)NCCCOCCCCC#C)CC(=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C34H47N3O3/c1-10-11-12-13-16-40-17-14-15-35-32-36-28-18-23(2)24(3)19-29(28)37(32)22-30(38)25-20-26(33(4,5)6)31(39)27(21-25)34(7,8)9/h1,18-21,39H,11-17,22H2,2-9H3,(H,35,36)