2-[(2E)-2-[(3-fluorophenyl)methylidene]-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]ethanamide

Systemtic Name: 2-[(2E)-2-[(3-fluorophenyl)methylidene]-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]ethanamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-2-[(2E)-2-[(3-fluorophenyl)methylene]-3-oxo-1,4-benzoxazin-4-yl]acetamide CAS Name: 2-[(2E)-2-[(3-fluorophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]-N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]acetamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-2-[(2E)-2-[(3-fluorophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]acetamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-2-[(2E)-2-(3-fluorobenzylidene)-3-keto-1,4-benzoxazin-4-yl]acetamide Formula: C30H32FN3O3 MolecularWeight: 501.591783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCNC(=O)CN1C2=CC=CC=C2OC(=CC3=CC(=CC=C3)F)C1=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)N(CCCNC(=O)CN1C2=CC=CC=C2O/C(=C/C3=CC(=CC=C3)F)/C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C30H32FN3O3/c1-22(2)33(20-23-10-4-3-5-11-23)17-9-16-32-29(35)21-34-26-14-6-7-15-27(26)37-28(30(34)36)19-24-12-8-13-25(31)18-24/h3-8,10-15,18-19,22H,9,16-17,20-21H2,1-2H3,(H,32,35)/b28-19+