(2S)-2-(4-chloranyl-3-methyl-phenoxy)-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propanamide

Systemtic Name: (2S)-2-(4-chloranyl-3-methyl-phenoxy)-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propanamide Openeye Name: (2S)-2-(4-chloro-3-methyl-phenoxy)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)propanamide CAS Name: (2S)-2-(4-chloro-3-methylphenoxy)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)propanamide IUPAC Name: (2S)-2-(4-chloro-3-methylphenoxy)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)propanamide Traditional Name: (2S)-2-(4-chloro-3-methyl-phenoxy)-N-(3-keto-4H-1,4-benzoxazin-6-yl)propionamide Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C)C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)O[C@@H](C)C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C18H17ClN2O4/c1-10-7-13(4-5-14(10)19)25-11(2)18(23)20-12-3-6-16-15(8-12)21-17(22)9-24-16/h3-8,11H,9H2,1-2H3,(H,20,23)(H,21,22)/t11-/m0/s1