4-hexyl-9-[4-(3-hydroxyphenyl)sulfanylphenyl]-4,9-diazaspiro[4.4]nonane-3,8-dione

Systemtic Name: 4-hexyl-9-[4-(3-hydroxyphenyl)sulfanylphenyl]-4,9-diazaspiro[4.4]nonane-3,8-dione Openeye Name: 4-hexyl-9-[4-(3-hydroxyphenyl)sulfanylphenyl]-4,9-diazaspiro[4.4]nonane-3,8-dione CAS Name: 4-hexyl-9-[4-[(3-hydroxyphenyl)thio]phenyl]-4,9-diazaspiro[4.4]nonane-3,8-dione IUPAC Name: 4-hexyl-9-[4-(3-hydroxyphenyl)sulfanylphenyl]-4,9-diazaspiro[4.4]nonane-3,8-dione Traditional Name: 4-hexyl-9-[4-[(3-hydroxyphenyl)thio]phenyl]-4,9-diazaspiro[4.4]nonane-3,8-quinone Formula: C25H30N2O3S MolecularWeight: 438.5823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)CCC12CCC(=O)N2C3=CC=C(C=C3)SC4=CC=CC(=C4)O

Isomeric SMILES

CCCCCCN1C(=O)CCC12CCC(=O)N2C3=CC=C(C=C3)SC4=CC=CC(=C4)O

InChI

InChI=1S/C25H30N2O3S/c1-2-3-4-5-17-26-23(29)13-15-25(26)16-14-24(30)27(25)19-9-11-21(12-10-19)31-22-8-6-7-20(28)18-22/h6-12,18,28H,2-5,13-17H2,1H3