2-[(2S)-6-[(1R)-1-azanylpropyl]-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-butyl-ethanamide

Systemtic Name: 2-[(2S)-6-[(1R)-1-azanylpropyl]-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-butyl-ethanamide Openeye Name: 2-[(2S)-6-[(1R)-1-aminopropyl]-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]-N-butyl-acetamide CAS Name: 2-[(2S)-6-[(1R)-1-aminopropyl]-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]-N-butylacetamide IUPAC Name: 2-[(2S)-6-[(1R)-1-aminopropyl]-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]-N-butylacetamide Traditional Name: 2-[(2S)-6-[(1R)-1-aminopropyl]-2-ethyl-3-keto-1,4-benzoxazin-4-yl]-N-butyl-acetamide Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1C2=C(C=CC(=C2)C(CC)N)OC(C1=O)CC

Isomeric SMILES

CCCCNC(=O)CN1C2=C(C=CC(=C2)[C@@H](CC)N)O[C@H](C1=O)CC

InChI

InChI=1S/C19H29N3O3/c1-4-7-10-21-18(23)12-22-15-11-13(14(20)5-2)8-9-17(15)25-16(6-3)19(22)24/h8-9,11,14,16H,4-7,10,12,20H2,1-3H3,(H,21,23)/t14-,16+/m1/s1