2-[(1S)-1-(benzotriazol-1-yl)-9-[(2S)-oxan-2-yl]oxy-nonyl]-4-methyl-phenol

Systemtic Name: 2-[(1S)-1-(benzotriazol-1-yl)-9-[(2S)-oxan-2-yl]oxy-nonyl]-4-methyl-phenol Openeye Name: 2-[(1S)-1-(benzotriazol-1-yl)-9-[(2S)-tetrahydropyran-2-yl]oxy-nonyl]-4-methyl-phenol CAS Name: 2-[(1S)-1-(1-benzotriazolyl)-9-[[(2S)-2-oxanyl]oxy]nonyl]-4-methylphenol IUPAC Name: 2-[(1S)-1-(benzotriazol-1-yl)-9-[(2S)-oxan-2-yl]oxynonyl]-4-methylphenol Traditional Name: 2-[(1S)-1-(benzotriazol-1-yl)-9-[(2S)-tetrahydropyran-2-yl]oxy-nonyl]-4-methyl-phenol Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(CCCCCCCCOC2CCCCO2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC(=C(C=C1)O)[C@H](CCCCCCCCO[C@H]2CCCCO2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C27H37N3O3/c1-21-16-17-26(31)22(20-21)24(30-25-14-8-7-12-23(25)28-29-30)13-6-4-2-3-5-10-18-32-27-15-9-11-19-33-27/h7-8,12,14,16-17,20,24,27,31H,2-6,9-11,13,15,18-19H2,1H3/t24-,27+/m0/s1