4-ethyl-5-[(3-fluorophenyl)methoxy]-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 4-ethyl-5-[(3-fluorophenyl)methoxy]-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 4-ethyl-5-[(3-fluorophenyl)methoxy]-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 4-ethyl-5-[(3-fluorophenyl)methoxy]-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 4-ethyl-5-[(3-fluorophenyl)methoxy]-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 4-ethyl-5-(3-fluorobenzyl)oxy-9H-$b-carboline-3-carboxylic acid Formula: C21H17FN2O3 MolecularWeight: 364.369683

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CN=C1C(=O)O)NC3=C2C(=CC=C3)OCC4=CC(=CC=C4)F

Isomeric SMILES

CCC1=C2C(=CN=C1C(=O)O)NC3=C2C(=CC=C3)OCC4=CC(=CC=C4)F

InChI

InChI=1S/C21H17FN2O3/c1-2-14-18-16(10-23-20(14)21(25)26)24-15-7-4-8-17(19(15)18)27-11-12-5-3-6-13(22)9-12/h3-10,24H,2,11H2,1H3,(H,25,26)