1-[5-[(5-azanyl-2,4,4-trimethyl-5-oxidanylidene-pentan-2-yl)carbamoylamino]-3-chloranyl-2-oxidanyl-phenyl]cyclobutane-1-carboxylic acid

Systemtic Name: 1-[5-[(5-azanyl-2,4,4-trimethyl-5-oxidanylidene-pentan-2-yl)carbamoylamino]-3-chloranyl-2-oxidanyl-phenyl]cyclobutane-1-carboxylic acid Openeye Name: 1-[5-[(4-amino-1,1,3,3-tetramethyl-4-oxo-butyl)carbamoylamino]-3-chloro-2-hydroxy-phenyl]cyclobutanecarboxylic acid CAS Name: 1-[5-[[[(5-amino-2,4,4-trimethyl-5-oxopentan-2-yl)amino]-oxomethyl]amino]-3-chloro-2-hydroxyphenyl]-1-cyclobutanecarboxylic acid IUPAC Name: 1-[5-[(5-amino-2,4,4-trimethyl-5-oxopentan-2-yl)carbamoylamino]-3-chloro-2-hydroxyphenyl]cyclobutane-1-carboxylic acid Traditional Name: 1-[5-[(4-amino-4-keto-1,1,3,3-tetramethyl-butyl)carbamoylamino]-3-chloro-2-hydroxy-phenyl]cyclobutanecarboxylic acid Formula: C20H28ClN3O5 MolecularWeight: 425.90642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C)(C)NC(=O)NC1=CC(=C(C(=C1)C2(CCC2)C(=O)O)O)Cl)C(=O)N

Isomeric SMILES

CC(C)(CC(C)(C)NC(=O)NC1=CC(=C(C(=C1)C2(CCC2)C(=O)O)O)Cl)C(=O)N

InChI

InChI=1S/C20H28ClN3O5/c1-18(2,15(22)26)10-19(3,4)24-17(29)23-11-8-12(14(25)13(21)9-11)20(16(27)28)6-5-7-20/h8-9,25H,5-7,10H2,1-4H3,(H2,22,26)(H,27,28)(H2,23,24,29)