2,3-dihydro-1,4-benzoxazin-4-yl-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzoxazin-4-yl-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzoxazin-4-yl-[5-[(2R)-pyrrolidin-1-ium-2-yl]-2-thienyl]methanone CAS Name: 2,3-dihydro-1,4-benzoxazin-4-yl-[5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzoxazin-4-yl-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzoxazin-4-yl-[5-[(2R)-pyrrolidin-1-ium-2-yl]-2-thienyl]methanone Formula: C17H19N2O2S+ MolecularWeight: 315.40996

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C2=CC=C(S2)C(=O)N3CCOC4=CC=CC=C43

Isomeric SMILES

C1C[C@@H]([NH2+]C1)C2=CC=C(S2)C(=O)N3CCOC4=CC=CC=C43

InChI

InChI=1S/C17H18N2O2S/c20-17(16-8-7-15(22-16)12-4-3-9-18-12)19-10-11-21-14-6-2-1-5-13(14)19/h1-2,5-8,12,18H,3-4,9-11H2/p+1/t12-/m1/s1