[(4S)-4-[2,4-bis(oxidanylidene)-1,3-benzoxazin-3-yl]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[2,4-bis(oxidanylidene)-1,3-benzoxazin-3-yl]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-(2,4-dioxo-1,3-benzoxazin-3-yl)pentyl]-diethyl-ammonium CAS Name: [(4S)-4-(2,4-dioxo-1,3-benzoxazin-3-yl)pentyl]-diethylammonium IUPAC Name: [(4S)-4-(2,4-dioxo-1,3-benzoxazin-3-yl)pentyl]-diethylazanium Traditional Name: [(4S)-4-(2,4-diketo-1,3-benzoxazin-3-yl)pentyl]-diethyl-ammonium Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)N1C(=O)C2=CC=CC=C2OC1=O

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)N1C(=O)C2=CC=CC=C2OC1=O

InChI

InChI=1S/C17H24N2O3/c1-4-18(5-2)12-8-9-13(3)19-16(20)14-10-6-7-11-15(14)22-17(19)21/h6-7,10-11,13H,4-5,8-9,12H2,1-3H3/p+1/t13-/m0/s1