(2S)-2-[3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoylamino]-N-propyl-propanamide CAS Name: (2S)-2-[[1-oxo-3-(3-oxo-1,4-benzoxazin-4-yl)propyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoylamino]-N-propylpropanamide Traditional Name: (2S)-2-[3-(3-keto-1,4-benzoxazin-4-yl)propanoylamino]-N-propyl-propionamide Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CCN1C(=O)COC2=CC=CC=C21

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CCN1C(=O)COC2=CC=CC=C21

InChI

InChI=1S/C17H23N3O4/c1-3-9-18-17(23)12(2)19-15(21)8-10-20-13-6-4-5-7-14(13)24-11-16(20)22/h4-7,12H,3,8-11H2,1-2H3,(H,18,23)(H,19,21)/t12-/m0/s1