3,5-bis(chloranyl)-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-propoxy-benzamide

Systemtic Name: 3,5-bis(chloranyl)-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-propoxy-benzamide Openeye Name: 3,5-dichloro-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-propoxy-benzamide CAS Name: 3,5-dichloro-N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-propoxybenzamide IUPAC Name: 3,5-dichloro-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-4-propoxybenzamide Traditional Name: 3,5-dichloro-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-propoxy-benzamide Formula: C20H25Cl2N2O3+ MolecularWeight: 412.3301

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)NCC(C2=CC=CO2)[NH+]3CCCC3)Cl

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)NC[C@@H](C2=CC=CO2)[NH+]3CCCC3)Cl

InChI

InChI=1S/C20H24Cl2N2O3/c1-2-9-27-19-15(21)11-14(12-16(19)22)20(25)23-13-17(18-6-5-10-26-18)24-7-3-4-8-24/h5-6,10-12,17H,2-4,7-9,13H2,1H3,(H,23,25)/p+1/t17-/m0/s1