N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)propionamide Formula: C27H27FN2O3 MolecularWeight: 446.513283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)NC(=O)CCN3C4=CC=CC=C4OC(C3=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)NC(=O)CCN3C4=CC=CC=C4OC(C3=O)C

InChI

InChI=1S/C27H27FN2O3/c1-3-19-11-13-20(14-12-19)26(21-7-6-8-22(28)17-21)29-25(31)15-16-30-23-9-4-5-10-24(23)33-18(2)27(30)32/h4-14,17-18,26H,3,15-16H2,1-2H3,(H,29,31)