5-azanyl-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-6-oxidanyl-naphthalene-2-sulfonamide

Systemtic Name: 5-azanyl-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-6-oxidanyl-naphthalene-2-sulfonamide Openeye Name: 5-amino-N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-6-hydroxy-naphthalene-2-sulfonamide CAS Name: 5-amino-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-6-hydroxy-2-naphthalenesulfonamide IUPAC Name: 5-amino-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-6-hydroxynaphthalene-2-sulfonamide Traditional Name: 5-amino-N-[4-(2,4-ditert-amylphenoxy)butyl]-6-hydroxy-naphthalene-2-sulfonamide Formula: C30H42N2O4S MolecularWeight: 526.73048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNS(=O)(=O)C2=CC3=C(C=C2)C(=C(C=C3)O)N)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNS(=O)(=O)C2=CC3=C(C=C2)C(=C(C=C3)O)N)C(C)(C)CC

InChI

InChI=1S/C30H42N2O4S/c1-7-29(3,4)22-12-16-27(25(20-22)30(5,6)8-2)36-18-10-9-17-32-37(34,35)23-13-14-24-21(19-23)11-15-26(33)28(24)31/h11-16,19-20,32-33H,7-10,17-18,31H2,1-6H3