2-[5-(3-naphthalen-1-yloxypyrrolidin-1-yl)pentyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[5-(3-naphthalen-1-yloxypyrrolidin-1-yl)pentyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[5-[3-(1-naphthyloxy)pyrrolidin-1-yl]pentyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[5-[3-(1-naphthalenyloxy)-1-pyrrolidinyl]pentyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[5-(3-naphthalen-1-yloxypyrrolidin-1-yl)pentyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[5-[3-(1-naphthoxy)pyrrolidino]pentyl]-1,2-benzothiazol-3-one Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1OC2=CC=CC3=CC=CC=C32)CCCCCN4C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

C1CN(CC1OC2=CC=CC3=CC=CC=C32)CCCCCN4C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C26H28N2O4S/c29-26-23-12-4-5-14-25(23)33(30,31)28(26)17-7-1-6-16-27-18-15-21(19-27)32-24-13-8-10-20-9-2-3-11-22(20)24/h2-5,8-14,21H,1,6-7,15-19H2