oxan-4-yl-[(3S)-5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl]azanium

Systemtic Name: oxan-4-yl-[(3S)-5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl]azanium Openeye Name: [(3S)-5-oxo-1-phenethyl-pyrrolidin-3-yl]-tetrahydropyran-4-yl-ammonium CAS Name: 4-oxanyl-[(3S)-5-oxo-1-phenethyl-3-pyrrolidinyl]ammonium IUPAC Name: oxan-4-yl-[(3S)-5-oxo-1-phenethylpyrrolidin-3-yl]azanium Traditional Name: [(3S)-5-keto-1-phenethyl-pyrrolidin-3-yl]-tetrahydropyran-4-yl-ammonium Formula: C17H25N2O2+ MolecularWeight: 289.3926

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1[NH2+]C2CC(=O)N(C2)CCC3=CC=CC=C3

Isomeric SMILES

C1COCCC1[NH2+][C@H]2CC(=O)N(C2)CCC3=CC=CC=C3

InChI

InChI=1S/C17H24N2O2/c20-17-12-16(18-15-7-10-21-11-8-15)13-19(17)9-6-14-4-2-1-3-5-14/h1-5,15-16,18H,6-13H2/p+1/t16-/m0/s1