2-methyl-6-[4-(quinolin-2-ylmethoxy)butoxymethyl]benzoic acid

Systemtic Name: 2-methyl-6-[4-(quinolin-2-ylmethoxy)butoxymethyl]benzoic acid Openeye Name: 2-methyl-6-[4-(2-quinolylmethoxy)butoxymethyl]benzoic acid CAS Name: 2-methyl-6-[4-(2-quinolinylmethoxy)butoxymethyl]benzoic acid IUPAC Name: 2-methyl-6-[4-(quinolin-2-ylmethoxy)butoxymethyl]benzoic acid Traditional Name: 2-methyl-6-[4-(2-quinolylmethoxy)butoxymethyl]benzoic acid Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COCCCCOCC2=NC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COCCCCOCC2=NC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C23H25NO4/c1-17-7-6-9-19(22(17)23(25)26)15-27-13-4-5-14-28-16-20-12-11-18-8-2-3-10-21(18)24-20/h2-3,6-12H,4-5,13-16H2,1H3,(H,25,26)