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

Systemtic Name: 2-[5-(3-naphthalen-2-yloxypyrrolidin-1-yl)pentyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[5-[3-(2-naphthyloxy)pyrrolidin-1-yl]pentyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[5-[3-(2-naphthalenyloxy)-1-pyrrolidinyl]pentyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[5-(3-naphthalen-2-yloxypyrrolidin-1-yl)pentyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[5-[3-(2-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=CC3=CC=CC=C3C=C2)CCCCCN4C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

C1CN(CC1OC2=CC3=CC=CC=C3C=C2)CCCCCN4C(=O)C5=CC=CC=C5S4(=O)=O

InChI

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