[(1S)-1-[3-oxidanylidene-4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,4-benzoxazin-6-yl]propyl]azanium

Systemtic Name: [(1S)-1-[3-oxidanylidene-4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,4-benzoxazin-6-yl]propyl]azanium Openeye Name: [(1S)-1-[3-oxo-4-[2-oxo-2-(1-piperidyl)ethyl]-1,4-benzoxazin-6-yl]propyl]ammonium CAS Name: [(1S)-1-[3-oxo-4-[2-oxo-2-(1-piperidinyl)ethyl]-1,4-benzoxazin-6-yl]propyl]ammonium IUPAC Name: [(1S)-1-[3-oxo-4-(2-oxo-2-piperidin-1-ylethyl)-1,4-benzoxazin-6-yl]propyl]azanium Traditional Name: [(1S)-1-[3-keto-4-(2-keto-2-piperidino-ethyl)-1,4-benzoxazin-6-yl]propyl]ammonium Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCCCC3)[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCCCC3)[NH3+]

InChI

InChI=1S/C18H25N3O3/c1-2-14(19)13-6-7-16-15(10-13)21(18(23)12-24-16)11-17(22)20-8-4-3-5-9-20/h6-7,10,14H,2-5,8-9,11-12,19H2,1H3/p+1/t14-/m0/s1