1-(3-phenoxypropanoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 1-(3-phenoxypropanoylamino)cyclohexane-1-carboxylic acid Openeye Name: 1-(3-phenoxypropanoylamino)cyclohexanecarboxylic acid CAS Name: 1-[(1-oxo-3-phenoxypropyl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-(3-phenoxypropanoylamino)cyclohexane-1-carboxylic acid Traditional Name: 1-(3-phenoxypropanoylamino)cyclohexanecarboxylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)NC(=O)CCOC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)(C(=O)O)NC(=O)CCOC2=CC=CC=C2

InChI

InChI=1S/C16H21NO4/c18-14(9-12-21-13-7-3-1-4-8-13)17-16(15(19)20)10-5-2-6-11-16/h1,3-4,7-8H,2,5-6,9-12H2,(H,17,18)(H,19,20)