4-[1-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]indole-1-carboxylic acid

Systemtic Name: 4-[1-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]indole-1-carboxylic acid Openeye Name: 4-[1-(azetidin-3-yl)-2-tert-butoxy-2-oxo-ethoxy]indole-1-carboxylic acid CAS Name: 4-[1-(3-azetidinyl)-2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-1-indolecarboxylic acid IUPAC Name: 4-[1-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]indole-1-carboxylic acid Traditional Name: 4-[1-(azetidin-3-yl)-2-tert-butoxy-2-keto-ethoxy]indole-1-carboxylic acid Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1CNC1)OC2=CC=CC3=C2C=CN3C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)C(C1CNC1)OC2=CC=CC3=C2C=CN3C(=O)O

InChI

InChI=1S/C18H22N2O5/c1-18(2,3)25-16(21)15(11-9-19-10-11)24-14-6-4-5-13-12(14)7-8-20(13)17(22)23/h4-8,11,15,19H,9-10H2,1-3H3,(H,22,23)