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

Systemtic Name: 2-[6-[(1S)-1-azanylethyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-butyl-ethanamide Openeye Name: 2-[6-[(1S)-1-aminoethyl]-3-oxo-1,4-benzoxazin-4-yl]-N-butyl-acetamide CAS Name: 2-[6-[(1S)-1-aminoethyl]-3-oxo-1,4-benzoxazin-4-yl]-N-butylacetamide IUPAC Name: 2-[6-[(1S)-1-aminoethyl]-3-oxo-1,4-benzoxazin-4-yl]-N-butylacetamide Traditional Name: 2-[6-[(1S)-1-aminoethyl]-3-keto-1,4-benzoxazin-4-yl]-N-butyl-acetamide Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O3/c1-3-4-7-18-15(20)9-19-13-8-12(11(2)17)5-6-14(13)22-10-16(19)21/h5-6,8,11H,3-4,7,9-10,17H2,1-2H3,(H,18,20)/t11-/m0/s1