9-[cyclohexyl(phenyl)amino]-9-oxidanylidene-nonanoic acid

Systemtic Name: 9-[cyclohexyl(phenyl)amino]-9-oxidanylidene-nonanoic acid Openeye Name: 9-(N-cyclohexylanilino)-9-oxo-nonanoic acid CAS Name: 9-(N-cyclohexylanilino)-9-oxononanoic acid IUPAC Name: 9-(N-cyclohexylanilino)-9-oxononanoic acid Traditional Name: 9-(N-cyclohexylanilino)-9-keto-pelargonic acid Formula: C21H31NO3 MolecularWeight: 345.47574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2=CC=CC=C2)C(=O)CCCCCCCC(=O)O

Isomeric SMILES

C1CCC(CC1)N(C2=CC=CC=C2)C(=O)CCCCCCCC(=O)O

InChI

InChI=1S/C21H31NO3/c23-20(16-10-2-1-3-11-17-21(24)25)22(18-12-6-4-7-13-18)19-14-8-5-9-15-19/h4,6-7,12-13,19H,1-3,5,8-11,14-17H2,(H,24,25)