6-(4-chlorophenyl)-3-[(1-methoxy-3,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]hexanoic acid

Systemtic Name: 6-(4-chlorophenyl)-3-[(1-methoxy-3,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]hexanoic acid Openeye Name: 6-(4-chlorophenyl)-3-[(1-methoxycarbonyl-2,2-dimethyl-propyl)carbamoyl]hexanoic acid CAS Name: 6-(4-chlorophenyl)-3-[[(1-methoxy-3,3-dimethyl-1-oxobutan-2-yl)amino]-oxomethyl]hexanoic acid IUPAC Name: 6-(4-chlorophenyl)-3-[(1-methoxy-3,3-dimethyl-1-oxobutan-2-yl)carbamoyl]hexanoic acid Traditional Name: 3-[(1-carbomethoxy-2,2-dimethyl-propyl)carbamoyl]-6-(4-chlorophenyl)hexanoic acid Formula: C20H28ClNO5 MolecularWeight: 397.89302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)OC)NC(=O)C(CCCC1=CC=C(C=C1)Cl)CC(=O)O

Isomeric SMILES

CC(C)(C)C(C(=O)OC)NC(=O)C(CCCC1=CC=C(C=C1)Cl)CC(=O)O

InChI

InChI=1S/C20H28ClNO5/c1-20(2,3)17(19(26)27-4)22-18(25)14(12-16(23)24)7-5-6-13-8-10-15(21)11-9-13/h8-11,14,17H,5-7,12H2,1-4H3,(H,22,25)(H,23,24)