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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O3/c1-5-7-10-21(4)18(23)12-22-15-11-14(13(3)20)8-9-17(15)25-16(6-2)19(22)24/h8-9,11,13,16H,5-7,10,12,20H2,1-4H3/t13-,16-/m0/s1