3-[[1-(1,3-benzothiazol-2-ylmethoxy)naphthalen-2-yl]carbonylamino]cyclobutane-1-carboxylic acid

Systemtic Name: 3-[[1-(1,3-benzothiazol-2-ylmethoxy)naphthalen-2-yl]carbonylamino]cyclobutane-1-carboxylic acid Openeye Name: 3-[[1-(1,3-benzothiazol-2-ylmethoxy)naphthalene-2-carbonyl]amino]cyclobutanecarboxylic acid CAS Name: 3-[[[1-(1,3-benzothiazol-2-ylmethoxy)-2-naphthalenyl]-oxomethyl]amino]-1-cyclobutanecarboxylic acid IUPAC Name: 3-[[1-(1,3-benzothiazol-2-ylmethoxy)naphthalene-2-carbonyl]amino]cyclobutane-1-carboxylic acid Traditional Name: 3-[[1-(1,3-benzothiazol-2-ylmethoxy)-2-naphthoyl]amino]cyclobutanecarboxylic acid Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC1NC(=O)C2=C(C3=CC=CC=C3C=C2)OCC4=NC5=CC=CC=C5S4)C(=O)O

Isomeric SMILES

C1C(CC1NC(=O)C2=C(C3=CC=CC=C3C=C2)OCC4=NC5=CC=CC=C5S4)C(=O)O

InChI

InChI=1S/C24H20N2O4S/c27-23(25-16-11-15(12-16)24(28)29)18-10-9-14-5-1-2-6-17(14)22(18)30-13-21-26-19-7-3-4-8-20(19)31-21/h1-10,15-16H,11-13H2,(H,25,27)(H,28,29)