N-(2-ethoxyphenyl)-2-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenoxy]propanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenoxy]propanamide Openeye Name: N-(2-ethoxyphenyl)-2-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenoxy]propanamide CAS Name: N-(2-ethoxyphenyl)-2-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenoxy]propanamide IUPAC Name: N-(2-ethoxyphenyl)-2-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenoxy]propanamide Traditional Name: N-o-phenetyl-2-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazol[4,3-a]azepin-3-yl)phenoxy]propionamide Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)OC2=CC=CC(=C2)C3=NN=C4N3CCCCC4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C)OC2=CC=CC(=C2)C3=NN=C4N3CCCCC4

InChI

InChI=1S/C24H28N4O3/c1-3-30-21-13-7-6-12-20(21)25-24(29)17(2)31-19-11-9-10-18(16-19)23-27-26-22-14-5-4-8-15-28(22)23/h6-7,9-13,16-17H,3-5,8,14-15H2,1-2H3,(H,25,29)