2,2-bis[3-chloranyl-4-(quinolin-2-ylmethoxy)phenyl]pentanoic acid

Systemtic Name: 2,2-bis[3-chloranyl-4-(quinolin-2-ylmethoxy)phenyl]pentanoic acid Openeye Name: 2,2-bis[3-chloro-4-(2-quinolylmethoxy)phenyl]pentanoic acid CAS Name: 2,2-bis[3-chloro-4-(2-quinolinylmethoxy)phenyl]pentanoic acid IUPAC Name: 2,2-bis[3-chloro-4-(quinolin-2-ylmethoxy)phenyl]pentanoic acid Traditional Name: 2,2-bis[3-chloro-4-(2-quinolylmethoxy)phenyl]valeric acid Formula: C37H30Cl2N2O4 MolecularWeight: 637.5511

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)Cl)(C4=CC(=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)Cl)C(=O)O

Isomeric SMILES

CCCC(C1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)Cl)(C4=CC(=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)Cl)C(=O)O

InChI

InChI=1S/C37H30Cl2N2O4/c1-2-19-37(36(42)43,26-13-17-34(30(38)20-26)44-22-28-15-11-24-7-3-5-9-32(24)40-28)27-14-18-35(31(39)21-27)45-23-29-16-12-25-8-4-6-10-33(25)41-29/h3-18,20-21H,2,19,22-23H2,1H3,(H,42,43)