2-[4-[[heptyl-[(2-phenylphenyl)carbamoyl]amino]methyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[[heptyl-[(2-phenylphenyl)carbamoyl]amino]methyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[heptyl-[(2-phenylphenyl)carbamoyl]amino]methyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[heptyl-[oxo-(2-phenylanilino)methyl]amino]methyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[heptyl-[(2-phenylphenyl)carbamoyl]amino]methyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[heptyl-[(2-phenylphenyl)carbamoyl]amino]methyl]phenoxy]-2-methyl-propionic acid Formula: C31H38N2O4 MolecularWeight: 502.64442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)OC(C)(C)C(=O)O)C(=O)NC2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)OC(C)(C)C(=O)O)C(=O)NC2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C31H38N2O4/c1-4-5-6-7-13-22-33(23-24-18-20-26(21-19-24)37-31(2,3)29(34)35)30(36)32-28-17-12-11-16-27(28)25-14-9-8-10-15-25/h8-12,14-21H,4-7,13,22-23H2,1-3H3,(H,32,36)(H,34,35)