3-[[4-[[(4-tert-butylcyclohexyl)-[(4-phenylphenyl)carbamoyl]amino]methyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[[(4-tert-butylcyclohexyl)-[(4-phenylphenyl)carbamoyl]amino]methyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[[(4-tert-butylcyclohexyl)-[(4-phenylphenyl)carbamoyl]amino]methyl]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[[(4-tert-butylcyclohexyl)-[oxo-(4-phenylanilino)methyl]amino]methyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[[(4-tert-butylcyclohexyl)-[(4-phenylphenyl)carbamoyl]amino]methyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[[(4-tert-butylcyclohexyl)-[(4-phenylphenyl)carbamoyl]amino]methyl]benzoyl]amino]propionic acid Formula: C34H41N3O4 MolecularWeight: 555.70704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)N(CC2=CC=C(C=C2)C(=O)NCCC(=O)O)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1CCC(CC1)N(CC2=CC=C(C=C2)C(=O)NCCC(=O)O)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C34H41N3O4/c1-34(2,3)28-15-19-30(20-16-28)37(23-24-9-11-27(12-10-24)32(40)35-22-21-31(38)39)33(41)36-29-17-13-26(14-18-29)25-7-5-4-6-8-25/h4-14,17-18,28,30H,15-16,19-23H2,1-3H3,(H,35,40)(H,36,41)(H,38,39)