3-[4-[2-[1,3-benzoxazol-2-yl(hex-5-enyl)amino]ethyl]phenoxy]-3-methyl-butan-2-one

Systemtic Name: 3-[4-[2-[1,3-benzoxazol-2-yl(hex-5-enyl)amino]ethyl]phenoxy]-3-methyl-butan-2-one Openeye Name: 3-[4-[2-[1,3-benzoxazol-2-yl(hex-5-enyl)amino]ethyl]phenoxy]-3-methyl-butan-2-one CAS Name: 3-[4-[2-[1,3-benzoxazol-2-yl(hex-5-enyl)amino]ethyl]phenoxy]-3-methyl-2-butanone IUPAC Name: 3-[4-[2-[1,3-benzoxazol-2-yl(hex-5-enyl)amino]ethyl]phenoxy]-3-methylbutan-2-one Traditional Name: 3-[4-[2-[1,3-benzoxazol-2-yl(hex-5-enyl)amino]ethyl]phenoxy]-3-methyl-butan-2-one Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)OC1=CC=C(C=C1)CCN(CCCCC=C)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(=O)C(C)(C)OC1=CC=C(C=C1)CCN(CCCCC=C)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C26H32N2O3/c1-5-6-7-10-18-28(25-27-23-11-8-9-12-24(23)30-25)19-17-21-13-15-22(16-14-21)31-26(3,4)20(2)29/h5,8-9,11-16H,1,6-7,10,17-19H2,2-4H3