3-[2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 3-[2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 3-[2-[(4-methylcyclohexyl)amino]-2-oxo-ethoxy]benzoic acid CAS Name: 3-[2-[(4-methylcyclohexyl)amino]-2-oxoethoxy]benzoic acid IUPAC Name: 3-[2-[(4-methylcyclohexyl)amino]-2-oxoethoxy]benzoic acid Traditional Name: 3-[2-keto-2-[(4-methylcyclohexyl)amino]ethoxy]benzoic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)COC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1CCC(CC1)NC(=O)COC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-11-5-7-13(8-6-11)17-15(18)10-21-14-4-2-3-12(9-14)16(19)20/h2-4,9,11,13H,5-8,10H2,1H3,(H,17,18)(H,19,20)