1-methyl-3-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]indole-6-carboxylic acid

Systemtic Name: 1-methyl-3-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]indole-6-carboxylic acid Openeye Name: 1-methyl-3-[[4-(2-quinolylmethoxy)phenyl]methyl]indole-6-carboxylic acid CAS Name: 1-methyl-3-[[4-(2-quinolinylmethoxy)phenyl]methyl]-6-indolecarboxylic acid IUPAC Name: 1-methyl-3-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]indole-6-carboxylic acid Traditional Name: 1-methyl-3-[4-(2-quinolylmethoxy)benzyl]indole-6-carboxylic acid Formula: C27H22N2O3 MolecularWeight: 422.47518

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=C(C=C2)C(=O)O)CC3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CN1C=C(C2=C1C=C(C=C2)C(=O)O)CC3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H22N2O3/c1-29-16-21(24-13-9-20(27(30)31)15-26(24)29)14-18-6-11-23(12-7-18)32-17-22-10-8-19-4-2-3-5-25(19)28-22/h2-13,15-16H,14,17H2,1H3,(H,30,31)