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

Systemtic Name: 3,5-bis(chloranyl)-4-ethoxy-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3,5-dichloro-4-ethoxy-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 3,5-dichloro-4-ethoxy-N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 3,5-dichloro-4-ethoxy-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 3,5-dichloro-4-ethoxy-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C19H23Cl2N2O3+ MolecularWeight: 398.30352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)NCC(C2=CC=CO2)[NH+]3CCCC3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)NC[C@@H](C2=CC=CO2)[NH+]3CCCC3)Cl

InChI

InChI=1S/C19H22Cl2N2O3/c1-2-25-18-14(20)10-13(11-15(18)21)19(24)22-12-16(17-6-5-9-26-17)23-7-3-4-8-23/h5-6,9-11,16H,2-4,7-8,12H2,1H3,(H,22,24)/p+1/t16-/m0/s1