2-[[(1S,3R)-3-methoxycarbonyl-2,2,3-trimethyl-cyclopentyl]carbonylamino]benzoate

Systemtic Name: 2-[[(1S,3R)-3-methoxycarbonyl-2,2,3-trimethyl-cyclopentyl]carbonylamino]benzoate Openeye Name: 2-[[(1S,3R)-3-methoxycarbonyl-2,2,3-trimethyl-cyclopentanecarbonyl]amino]benzoate CAS Name: 2-[[[(1S,3R)-3-methoxycarbonyl-2,2,3-trimethylcyclopentyl]-oxomethyl]amino]benzoate IUPAC Name: 2-[[(1S,3R)-3-methoxycarbonyl-2,2,3-trimethylcyclopentanecarbonyl]amino]benzoate Traditional Name: 2-[[(1S,3R)-3-carbomethoxy-2,2,3-trimethyl-cyclopentanecarbonyl]amino]benzoate Formula: C18H22NO5- MolecularWeight: 332.37098

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)OC)C(=O)NC2=CC=CC=C2C(=O)[O-])C

Isomeric SMILES

C[C@]1(CC[C@@H](C1(C)C)C(=O)NC2=CC=CC=C2C(=O)[O-])C(=O)OC

InChI

InChI=1S/C18H23NO5/c1-17(2)12(9-10-18(17,3)16(23)24-4)14(20)19-13-8-6-5-7-11(13)15(21)22/h5-8,12H,9-10H2,1-4H3,(H,19,20)(H,21,22)/p-1/t12-,18+/m1/s1