2-[3-(cyclohexylamino)-3-oxidanylidene-propoxy]benzoic acid

Systemtic Name: 2-[3-(cyclohexylamino)-3-oxidanylidene-propoxy]benzoic acid Openeye Name: 2-[3-(cyclohexylamino)-3-oxo-propoxy]benzoic acid CAS Name: 2-[3-(cyclohexylamino)-3-oxopropoxy]benzoic acid IUPAC Name: 2-[3-(cyclohexylamino)-3-oxopropoxy]benzoic acid Traditional Name: 2-[3-(cyclohexylamino)-3-keto-propoxy]benzoic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCOC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)CCOC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H21NO4/c18-15(17-12-6-2-1-3-7-12)10-11-21-14-9-5-4-8-13(14)16(19)20/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,17,18)(H,19,20)