3-[4-(5-chloranyl-2-methoxy-phenyl)phenyl]-2-[(2-methyloxan-2-yl)amino]propanoic acid

Systemtic Name: 3-[4-(5-chloranyl-2-methoxy-phenyl)phenyl]-2-[(2-methyloxan-2-yl)amino]propanoic acid Openeye Name: 3-[4-(5-chloro-2-methoxy-phenyl)phenyl]-2-[(2-methyltetrahydropyran-2-yl)amino]propanoic acid CAS Name: 3-[4-(5-chloro-2-methoxyphenyl)phenyl]-2-[(2-methyl-2-oxanyl)amino]propanoic acid IUPAC Name: 3-[4-(5-chloro-2-methoxyphenyl)phenyl]-2-[(2-methyloxan-2-yl)amino]propanoic acid Traditional Name: 3-[4-(5-chloro-2-methoxy-phenyl)phenyl]-2-[(2-methyltetrahydropyran-2-yl)amino]propionic acid Formula: C22H26ClNO4 MolecularWeight: 403.89914

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCO1)NC(CC2=CC=C(C=C2)C3=C(C=CC(=C3)Cl)OC)C(=O)O

Isomeric SMILES

CC1(CCCCO1)NC(CC2=CC=C(C=C2)C3=C(C=CC(=C3)Cl)OC)C(=O)O

InChI

InChI=1S/C22H26ClNO4/c1-22(11-3-4-12-28-22)24-19(21(25)26)13-15-5-7-16(8-6-15)18-14-17(23)9-10-20(18)27-2/h5-10,14,19,24H,3-4,11-13H2,1-2H3,(H,25,26)