4-(benzotriazol-1-ylmethyl)-N-[3-(3-fluoranylphenoxy)-2-oxidanyl-propyl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[3-(3-fluoranylphenoxy)-2-oxidanyl-propyl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[3-(3-fluorophenoxy)-2-hydroxy-propyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[3-(3-fluorophenoxy)-2-hydroxypropyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[3-(3-fluorophenoxy)-2-hydroxypropyl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[3-(3-fluorophenoxy)-2-hydroxy-propyl]benzamide Formula: C23H21FN4O3 MolecularWeight: 420.436243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C(=O)NCC(COC4=CC(=CC=C4)F)O

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C(=O)NCC(COC4=CC(=CC=C4)F)O

InChI

InChI=1S/C23H21FN4O3/c24-18-4-3-5-20(12-18)31-15-19(29)13-25-23(30)17-10-8-16(9-11-17)14-28-22-7-2-1-6-21(22)26-27-28/h1-12,19,29H,13-15H2,(H,25,30)