3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide

Systemtic Name: 3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide Openeye Name: 3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide CAS Name: 3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide IUPAC Name: 3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]propanamide Traditional Name: 3-[(2S)-3-keto-2-methyl-1,4-benzoxazin-4-yl]-N-(2,4,5-trimethoxybenzyl)propionamide Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCC3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

C[C@H]1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCC3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C22H26N2O6/c1-14-22(26)24(16-7-5-6-8-17(16)30-14)10-9-21(25)23-13-15-11-19(28-3)20(29-4)12-18(15)27-2/h5-8,11-12,14H,9-10,13H2,1-4H3,(H,23,25)/t14-/m0/s1