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

Systemtic Name: 2-[6-[(1S)-1-azanylethyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-butyl-N-methyl-ethanamide Openeye Name: 2-[6-[(1S)-1-aminoethyl]-3-oxo-1,4-benzoxazin-4-yl]-N-butyl-N-methyl-acetamide CAS Name: 2-[6-[(1S)-1-aminoethyl]-3-oxo-1,4-benzoxazin-4-yl]-N-butyl-N-methylacetamide IUPAC Name: 2-[6-[(1S)-1-aminoethyl]-3-oxo-1,4-benzoxazin-4-yl]-N-butyl-N-methylacetamide Traditional Name: 2-[6-[(1S)-1-aminoethyl]-3-keto-1,4-benzoxazin-4-yl]-N-butyl-N-methyl-acetamide Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CN1C(=O)COC2=C1C=C(C=C2)C(C)N

Isomeric SMILES

CCCCN(C)C(=O)CN1C(=O)COC2=C1C=C(C=C2)[C@H](C)N

InChI

InChI=1S/C17H25N3O3/c1-4-5-8-19(3)16(21)10-20-14-9-13(12(2)18)6-7-15(14)23-11-17(20)22/h6-7,9,12H,4-5,8,10-11,18H2,1-3H3/t12-/m0/s1