4-[4-[[4-(quinolin-2-ylmethoxy)phenyl]methylcarbamoyl]phenyl]butanoic acid

Systemtic Name: 4-[4-[[4-(quinolin-2-ylmethoxy)phenyl]methylcarbamoyl]phenyl]butanoic acid Openeye Name: 4-[4-[[4-(2-quinolylmethoxy)phenyl]methylcarbamoyl]phenyl]butanoic acid CAS Name: 4-[4-[oxo-[[4-(2-quinolinylmethoxy)phenyl]methylamino]methyl]phenyl]butanoic acid IUPAC Name: 4-[4-[[4-(quinolin-2-ylmethoxy)phenyl]methylcarbamoyl]phenyl]butanoic acid Traditional Name: 4-[4-[[4-(2-quinolylmethoxy)benzyl]carbamoyl]phenyl]butyric acid Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)CNC(=O)C4=CC=C(C=C4)CCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)CNC(=O)C4=CC=C(C=C4)CCCC(=O)O

InChI

InChI=1S/C28H26N2O4/c31-27(32)7-3-4-20-8-12-23(13-9-20)28(33)29-18-21-10-16-25(17-11-21)34-19-24-15-14-22-5-1-2-6-26(22)30-24/h1-2,5-6,8-17H,3-4,7,18-19H2,(H,29,33)(H,31,32)