(2S)-2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: (2S)-2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxidanylidene-butanoic acid Openeye Name: (2S)-2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxo-butanoic acid CAS Name: (2S)-2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid IUPAC Name: (2S)-2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-oxobutanoic acid Traditional Name: (2S)-2-(cyclohexylamino)-4-(4-cyclohexylphenyl)-4-keto-butyric acid Formula: C22H31NO3 MolecularWeight: 357.48644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CC(C(=O)O)NC3CCCCC3

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)C[C@@H](C(=O)O)NC3CCCCC3

InChI

InChI=1S/C22H31NO3/c24-21(15-20(22(25)26)23-19-9-5-2-6-10-19)18-13-11-17(12-14-18)16-7-3-1-4-8-16/h11-14,16,19-20,23H,1-10,15H2,(H,25,26)/t20-/m0/s1