guanidine; 2-[4-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)phenyl]-3-phenyl-propanoic acid

Systemtic Name: guanidine; 2-[4-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)phenyl]-3-phenyl-propanoic acid Openeye Name: 2-[4-(1-benzyl-2-hydroxy-2-oxo-ethyl)phenyl]-3-phenyl-propanoic acid; guanidine CAS Name: guanidine; 2-[4-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)phenyl]-3-phenylpropanoic acid IUPAC Name: guanidine; 2-[4-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)phenyl]-3-phenylpropanoic acid Traditional Name: 2-[4-(1-benzyl-2-hydroxy-2-keto-ethyl)phenyl]-3-phenyl-propionic acid; guanidine Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=CC=C(C=C2)C(CC3=CC=CC=C3)C(=O)O)C(=O)O.C(=N)(N)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C2=CC=C(C=C2)C(CC3=CC=CC=C3)C(=O)O)C(=O)O.C(=N)(N)N

InChI

InChI=1S/C24H22O4.CH5N3/c25-23(26)21(15-17-7-3-1-4-8-17)19-11-13-20(14-12-19)22(24(27)28)16-18-9-5-2-6-10-18;2-1(3)4/h1-14,21-22H,15-16H2,(H,25,26)(H,27,28);(H5,2,3,4)