3-[[4-[[(4-cyclohexylphenyl)amino]methyl]phenyl]carbonylamino]-2-oxidanyl-propanoic acid

Systemtic Name: 3-[[4-[[(4-cyclohexylphenyl)amino]methyl]phenyl]carbonylamino]-2-oxidanyl-propanoic acid Openeye Name: 3-[[4-[(4-cyclohexylanilino)methyl]benzoyl]amino]-2-hydroxy-propanoic acid CAS Name: 3-[[[4-[(4-cyclohexylanilino)methyl]phenyl]-oxomethyl]amino]-2-hydroxypropanoic acid IUPAC Name: 3-[[4-[(4-cyclohexylanilino)methyl]benzoyl]amino]-2-hydroxypropanoic acid Traditional Name: 3-[[4-[(4-cyclohexylanilino)methyl]benzoyl]amino]-2-hydroxy-propionic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)NCC3=CC=C(C=C3)C(=O)NCC(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)NCC3=CC=C(C=C3)C(=O)NCC(C(=O)O)O

InChI

InChI=1S/C23H28N2O4/c26-21(23(28)29)15-25-22(27)19-8-6-16(7-9-19)14-24-20-12-10-18(11-13-20)17-4-2-1-3-5-17/h6-13,17,21,24,26H,1-5,14-15H2,(H,25,27)(H,28,29)