N-[[3-(3-oxidanylprop-1-ynyl)phenyl]methoxy]-2-(pyridin-4-ylmethylamino)benzamide

Systemtic Name: N-[[3-(3-oxidanylprop-1-ynyl)phenyl]methoxy]-2-(pyridin-4-ylmethylamino)benzamide Openeye Name: N-[[3-(3-hydroxyprop-1-ynyl)phenyl]methoxy]-2-(4-pyridylmethylamino)benzamide CAS Name: N-[[3-(3-hydroxyprop-1-ynyl)phenyl]methoxy]-2-(pyridin-4-ylmethylamino)benzamide IUPAC Name: N-[[3-(3-hydroxyprop-1-ynyl)phenyl]methoxy]-2-(pyridin-4-ylmethylamino)benzamide Traditional Name: N-[3-(3-hydroxyprop-1-ynyl)benzyl]oxy-2-(4-pyridylmethylamino)benzamide Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NOCC2=CC=CC(=C2)C#CCO)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NOCC2=CC=CC(=C2)C#CCO)NCC3=CC=NC=C3

InChI

InChI=1S/C23H21N3O3/c27-14-4-7-18-5-3-6-20(15-18)17-29-26-23(28)21-8-1-2-9-22(21)25-16-19-10-12-24-13-11-19/h1-3,5-6,8-13,15,25,27H,14,16-17H2,(H,26,28)