2-[[4-(8-cyclohexyloctylamino)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-(8-cyclohexyloctylamino)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-(8-cyclohexyloctylamino)benzoyl]amino]acetic acid CAS Name: 2-[[[4-(8-cyclohexyloctylamino)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-(8-cyclohexyloctylamino)benzoyl]amino]acetic acid Traditional Name: 2-[[4-(8-cyclohexyloctylamino)benzoyl]amino]acetic acid Formula: C23H36N2O3 MolecularWeight: 388.54354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCCCCCCNC2=CC=C(C=C2)C(=O)NCC(=O)O

Isomeric SMILES

C1CCC(CC1)CCCCCCCCNC2=CC=C(C=C2)C(=O)NCC(=O)O

InChI

InChI=1S/C23H36N2O3/c26-22(27)18-25-23(28)20-13-15-21(16-14-20)24-17-9-4-2-1-3-6-10-19-11-7-5-8-12-19/h13-16,19,24H,1-12,17-18H2,(H,25,28)(H,26,27)