[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-4H-1,4-benzoxazin-2-yl]acetic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)CC1C(=O)NC2=CC=CC=C2O1

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C[C@H]1C(=O)NC2=CC=CC=C2O1

InChI

InChI=1S/C17H21N3O6/c1-2-3-8-18-17(24)20-14(21)10-25-15(22)9-13-16(23)19-11-6-4-5-7-12(11)26-13/h4-7,13H,2-3,8-10H2,1H3,(H,19,23)(H2,18,20,21,24)/t13-/m0/s1