2-[2-oxidanylidene-3-(3-phenylpropanoylamino)azepan-1-yl]propanoylazanide; yttrium(3+)

Systemtic Name: 2-[2-oxidanylidene-3-(3-phenylpropanoylamino)azepan-1-yl]propanoylazanide; yttrium(3+) Openeye Name: 2-[2-oxo-3-(3-phenylpropanoylamino)azepan-1-yl]propanoylazanide; yttrium(3+) CAS Name: [1-oxo-2-[2-oxo-3-[(1-oxo-3-phenylpropyl)amino]-1-azepanyl]propyl]azanide; yttrium(3+) IUPAC Name: 2-[2-oxo-3-(3-phenylpropanoylamino)azepan-1-yl]propanoylazanide; yttrium(3+) Traditional Name: 2-[3-(hydrocinnamoylamino)-2-keto-azepan-1-yl]propanoylazanide; yttrium(3+) Formula: C18H24N3O3Y+2 MolecularWeight: 419.30731

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[NH-])N1CCCCC(C1=O)NC(=O)CCC2=CC=CC=C2.[Y+3]

Isomeric SMILES

CC(C(=O)[NH-])N1CCCCC(C1=O)NC(=O)CCC2=CC=CC=C2.[Y+3]

InChI

InChI=1S/C18H25N3O3.Y/c1-13(17(19)23)21-12-6-5-9-15(18(21)24)20-16(22)11-10-14-7-3-2-4-8-14;/h2-4,7-8,13,15H,5-6,9-12H2,1H3,(H3,19,20,22,23);/q;+3/p-1